methyl 4-[(Z)-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[4-oxo-2-(4-phenylpiperazin-1-yl)thiazol-5-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[4-oxo-2-(4-phenyl-1-piperazinyl)-5-thiazolylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[4-oxo-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[4-keto-2-(4-phenylpiperazino)-2-thiazolin-5-ylidene]methyl]benzoic acid methyl ester Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C\2/C(=O)N=C(S2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-28-21(27)17-9-7-16(8-10-17)15-19-20(26)23-22(29-19)25-13-11-24(12-14-25)18-5-3-2-4-6-18/h2-10,15H,11-14H2,1H3/b19-15-