AC1M3CVM structure

AC1M3CVM

ethyl 2-[3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Also Known As: Oprea1_309729|VU0618118-1|F3394-0313|ETHYL 2-{3-[(5-METHYL-1,3,4-THIADIAZOL-2-YL)SULFANYL]PROPANAMIDO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|ethyl 2-(3-((5-methyl-1,3,4-thiadiazol-2-yl)thio)propanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-[3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

CAS: 690644-45-2
Molecular Formula C17H21N3O3S3
Molecular Weight 411.0745 g/mol
LogP 4.08442
Topological Polar Surface Area 81.18 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 7
Exact Mass 411.0745
Monoisotopic Mass 411.0745
Heavy Atoms 26
Complexity 800.5186

Chemical Identifiers

CAS Number 690644-45-2
SMILES CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCSC3=NN=C(S3)C

Product Overview

AC1M3CVM (CAS 690644-45-2), with molecular formula C17H21N3O3S3 and molecular weight 411.0745 g/mol. IUPAC: ethyl 2-[3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.

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