AC1NNQJU

3,6-dichloro-N-[3-[(1,1-dioxothiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzothiophene-2-carboxamide

Also Known As: 3,6-dichloro-N-{3-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-benzothiophene-2-carboxamide|3,6-dichloro-N-(3-((1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)benzo[b]thiophene-2-carboxamide|3,6-dichloro-N-[3-[(1,1-dioxothiolan-3-yl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-benzothiophene-2-carboxamide

Molecular Formula	C22H20Cl2N2O4S3
Molecular Weight	541.9962 g/mol
LogP	5.3176
Topological Polar Surface Area	92.34 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	541.9962
Monoisotopic Mass	541.9962
Heavy Atoms	33
Complexity	1394.258

Chemical Identifiers

CAS Number	797764-07-9
SMILES	C1CCC2=C(C1)C(=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)C(=O)NC5CCS(=O)(=O)C5