(3S)-5-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[(4,5-diphenylthiazol-2-yl)amino]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[(4,5-diphenyl-2-thiazolyl)amino]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[(4,5-diphenylthiazol-2-yl)amino]-5-keto-3-methyl-valerate Formula: C21H19N2O3S- MolecularWeight: 379.45216

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)[O-]

Isomeric SMILES

C[C@@H](CC(=O)NC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)[O-]

InChI

InChI=1S/C21H20N2O3S/c1-14(13-18(25)26)12-17(24)22-21-23-19(15-8-4-2-5-9-15)20(27-21)16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3,(H,25,26)(H,22,23,24)/p-1/t14-/m0/s1