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

Systemtic Name: 4-[(Z)-[2-[(4-butylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]benzoate Openeye Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-thiazol-5-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-5-thiazolylidene]methyl]benzoate IUPAC Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[2-(4-butylanilino)-4-keto-2-thiazolin-5-ylidene]methyl]benzoate Formula: C21H19N2O3S- MolecularWeight: 379.45216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC2=NC(=O)C(=CC3=CC=C(C=C3)C(=O)[O-])S2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC2=NC(=O)/C(=C/C3=CC=C(C=C3)C(=O)[O-])/S2

InChI

InChI=1S/C21H20N2O3S/c1-2-3-4-14-7-11-17(12-8-14)22-21-23-19(24)18(27-21)13-15-5-9-16(10-6-15)20(25)26/h5-13H,2-4H2,1H3,(H,25,26)(H,22,23,24)/p-1/b18-13-