(2S)-N-(4-ethylphenyl)-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]propanamide

Systemtic Name: (2S)-N-(4-ethylphenyl)-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]propanamide Openeye Name: (2S)-N-(4-ethylphenyl)-2-(3-pyrrolidin-1-ylsulfonylanilino)propanamide CAS Name: (2S)-N-(4-ethylphenyl)-2-[3-(1-pyrrolidinylsulfonyl)anilino]propanamide IUPAC Name: (2S)-N-(4-ethylphenyl)-2-(3-pyrrolidin-1-ylsulfonylanilino)propanamide Traditional Name: (2S)-N-(4-ethylphenyl)-2-(3-pyrrolidinosulfonylanilino)propionamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H27N3O3S/c1-3-17-9-11-18(12-10-17)23-21(25)16(2)22-19-7-6-8-20(15-19)28(26,27)24-13-4-5-14-24/h6-12,15-16,22H,3-5,13-14H2,1-2H3,(H,23,25)/t16-/m0/s1