ChemDiv3_014161 structure

ChemDiv3_014161

N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide

Also Known As: ChemDiv3_014161|IDI1_029959|F3394-1449|2-({11-methyl-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,5-tetraen-3-yl}sulfanyl)-N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]acetamide|N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide|2-((7-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-N-(5-(o-tolyl)-1,2,4-thiadiazol-3-yl)acetamide|N-[5-(2-METHYLPHENYL)-1,2,4-THIADIAZOL-3-YL]-2-[(7-METHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4-YL)SULFANYL]ACETAMIDE|N-[5-(o-tolyl)-1,2,4-thiadiazol-3-yl](7-methyl-9-thia-1,3-diaza-5,6,7,8-tetrahydro-4-fluorenylthio)acetamide

CAS: 892224-87-2
Molecular Formula C22H21N5OS3
Molecular Weight 467.09082 g/mol
LogP 5.37382
Topological Polar Surface Area 80.66 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 467.09082
Monoisotopic Mass 467.09082
Heavy Atoms 31
Complexity 1265.2604

Chemical Identifiers

CAS Number 892224-87-2
SMILES CC1CCC2=C(C1)SC3=C2C(=NC=N3)SCC(=O)NC4=NSC(=N4)C5=CC=CC=C5C

Product Overview

ChemDiv3_014161 (CAS 892224-87-2), with molecular formula C22H21N5OS3 and molecular weight 467.09082 g/mol. IUPAC: N-[5-(2-methylphenyl)-1,2,4-thiadiazol-3-yl]-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide.

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