N-[(2S)-1-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-1-pyrrolidin-1-yl-propan-2-yl]ethanamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-(4-phenoxyphenyl)sulfanyl-1-pyrrolidin-1-yl-propan-2-yl]ethanamide Openeye Name: N-[(1S)-2-oxo-1-[(4-phenoxyphenyl)sulfanylmethyl]-2-pyrrolidin-1-yl-ethyl]acetamide CAS Name: N-[(2S)-1-oxo-3-[(4-phenoxyphenyl)thio]-1-(1-pyrrolidinyl)propan-2-yl]acetamide IUPAC Name: N-[(2S)-1-oxo-3-(4-phenoxyphenyl)sulfanyl-1-pyrrolidin-1-ylpropan-2-yl]acetamide Traditional Name: N-[(1S)-2-keto-1-[[(4-phenoxyphenyl)thio]methyl]-2-pyrrolidino-ethyl]acetamide Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCCC3

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H24N2O3S/c1-16(24)22-20(21(25)23-13-5-6-14-23)15-27-19-11-9-18(10-12-19)26-17-7-3-2-4-8-17/h2-4,7-12,20H,5-6,13-15H2,1H3,(H,22,24)/t20-/m1/s1