N-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylethanoyl]thiophene-2-carboxamide Openeye Name: N-[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]sulfanyl]acetyl]thiophene-2-carboxamide CAS Name: N-[2-[[5-(1-azepanylsulfonyl)-2-pyridinyl]thio]-1-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[5-(azepan-1-ylsulfonyl)pyridin-2-yl]sulfanylacetyl]thiophene-2-carboxamide Traditional Name: N-[2-[[5-(azepan-1-ylsulfonyl)-2-pyridyl]thio]acetyl]thiophene-2-carboxamide Formula: C18H21N3O4S3 MolecularWeight: 439.57204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC(=O)C3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCC(=O)NC(=O)C3=CC=CS3

InChI

InChI=1S/C18H21N3O4S3/c22-16(20-18(23)15-6-5-11-26-15)13-27-17-8-7-14(12-19-17)28(24,25)21-9-3-1-2-4-10-21/h5-8,11-12H,1-4,9-10,13H2,(H,20,22,23)