(2S)-2-(4-methylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: (2S)-2-(4-methylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Openeye Name: (2S)-2-(4-methylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide CAS Name: (2S)-2-(4-methylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]butanamide IUPAC Name: (2S)-2-(4-methylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)butanamide Traditional Name: (2S)-2-(4-methylphenoxy)-N-(4-pyrrolidinosulfonylphenyl)butyramide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC=C(C=C3)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)OC3=CC=C(C=C3)C

InChI

InChI=1S/C21H26N2O4S/c1-3-20(27-18-10-6-16(2)7-11-18)21(24)22-17-8-12-19(13-9-17)28(25,26)23-14-4-5-15-23/h6-13,20H,3-5,14-15H2,1-2H3,(H,22,24)/t20-/m0/s1