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

Systemtic Name: 4-[(Z)-[2-[(4-butylphenyl)amino]-4-oxidanylidene-1,3-thiazol-5-ylidene]methyl]-2-methoxy-phenolate Openeye Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-thiazol-5-ylidene]methyl]-2-methoxy-phenolate CAS Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-5-thiazolylidene]methyl]-2-methoxyphenolate IUPAC Name: 4-[(Z)-[2-(4-butylanilino)-4-oxo-1,3-thiazol-5-ylidene]methyl]-2-methoxyphenolate Traditional Name: 4-[(Z)-[2-(4-butylanilino)-4-keto-2-thiazolin-5-ylidene]methyl]-2-methoxy-phenolate Formula: C21H21N2O3S- MolecularWeight: 381.46804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O3S/c1-3-4-5-14-6-9-16(10-7-14)22-21-23-20(25)19(27-21)13-15-8-11-17(24)18(12-15)26-2/h6-13,24H,3-5H2,1-2H3,(H,22,23,25)/p-1/b19-13-