(2S)-3-methyl-N-(4-piperidin-1-ylphenyl)-2-(thiophen-2-ylsulfonylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-(4-piperidin-1-ylphenyl)-2-(thiophen-2-ylsulfonylamino)butanamide Openeye Name: (2S)-3-methyl-N-[4-(1-piperidyl)phenyl]-2-(2-thienylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-N-[4-(1-piperidinyl)phenyl]-2-(thiophen-2-ylsulfonylamino)butanamide IUPAC Name: (2S)-3-methyl-N-(4-piperidin-1-ylphenyl)-2-(thiophen-2-ylsulfonylamino)butanamide Traditional Name: (2S)-3-methyl-N-(4-piperidinophenyl)-2-(2-thienylsulfonylamino)butyramide Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)N2CCCCC2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-15(2)19(22-28(25,26)18-7-6-14-27-18)20(24)21-16-8-10-17(11-9-16)23-12-4-3-5-13-23/h6-11,14-15,19,22H,3-5,12-13H2,1-2H3,(H,21,24)/t19-/m0/s1