ethyl 4-[[(5R)-3-methyl-4-oxidanylidene-5-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: ethyl 4-[[(5R)-3-methyl-4-oxidanylidene-5-(2-oxidanylidene-2-phenylazanyl-ethyl)-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: ethyl 4-[[(5R)-5-(2-anilino-2-oxo-ethyl)-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 4-[[(5R)-5-(2-anilino-2-oxoethyl)-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(5R)-5-(2-anilino-2-oxoethyl)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 4-[[(5R)-5-(2-anilino-2-keto-ethyl)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N=C2N(C(=O)[C@H](S2)CC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C21H21N3O4S/c1-3-28-20(27)14-9-11-16(12-10-14)23-21-24(2)19(26)17(29-21)13-18(25)22-15-7-5-4-6-8-15/h4-12,17H,3,13H2,1-2H3,(H,22,25)/t17-/m1/s1