N-[3-(azepan-1-ylsulfonyl)phenyl]-3-thiophen-3-yl-propanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-thiophen-3-yl-propanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-thienyl)propanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-3-(3-thiophenyl)propanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-thiophen-3-ylpropanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-thienyl)propionamide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCC3=CSC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCC3=CSC=C3

InChI

InChI=1S/C19H24N2O3S2/c22-19(9-8-16-10-13-25-15-16)20-17-6-5-7-18(14-17)26(23,24)21-11-3-1-2-4-12-21/h5-7,10,13-15H,1-4,8-9,11-12H2,(H,20,22)