N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide Formula: C21H26N2O4S2 MolecularWeight: 434.57214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC4=C(S3)CCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)C3=CC4=C(S3)CCC4

InChI

InChI=1S/C21H26N2O4S2/c1-27-18-10-9-16(29(25,26)23-11-4-2-3-5-12-23)14-17(18)22-21(24)20-13-15-7-6-8-19(15)28-20/h9-10,13-14H,2-8,11-12H2,1H3,(H,22,24)