N-[3-(azepan-1-ylsulfonyl)phenyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(2-thienyl)butanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-(2-thienyl)butyramide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C20H26N2O3S2/c23-20(12-6-9-18-10-7-15-26-18)21-17-8-5-11-19(16-17)27(24,25)22-13-3-1-2-4-14-22/h5,7-8,10-11,15-16H,1-4,6,9,12-14H2,(H,21,23)