6-(azepan-1-yl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]pyridine-3-carboxamide

Systemtic Name: 6-(azepan-1-yl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]pyridine-3-carboxamide Openeye Name: 6-(azepan-1-yl)-N-[(5-morpholinosulfonyl-2-thienyl)methyl]pyridine-3-carboxamide CAS Name: 6-(1-azepanyl)-N-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 6-(azepan-1-yl)-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]pyridine-3-carboxamide Traditional Name: 6-(azepan-1-yl)-N-[(5-morpholinosulfonyl-2-thienyl)methyl]nicotinamide Formula: C21H28N4O4S2 MolecularWeight: 464.60142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C=C2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H28N4O4S2/c26-21(17-5-7-19(22-15-17)24-9-3-1-2-4-10-24)23-16-18-6-8-20(30-18)31(27,28)25-11-13-29-14-12-25/h5-8,15H,1-4,9-14,16H2,(H,23,26)