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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-(2-thienyl)butanamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[4-(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=C(C=C2)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O3S2/c23-20(9-5-7-18-8-6-16-26-18)21-17-10-12-19(13-11-17)27(24,25)22-14-3-1-2-4-15-22/h6,8,10-13,16H,1-5,7,9,14-15H2,(H,21,23)