(4-methyl-5-oxidanylidene-2-phenyl-thieno[2,3-d]pyrimidin-6-ylidene)-[(4-methylphenyl)amino]methanolate

Systemtic Name: (4-methyl-5-oxidanylidene-2-phenyl-thieno[2,3-d]pyrimidin-6-ylidene)-[(4-methylphenyl)amino]methanolate Openeye Name: (4-methylanilino)-(4-methyl-5-oxo-2-phenyl-thieno[2,3-d]pyrimidin-6-ylidene)methanolate CAS Name: (4-methylanilino)-(4-methyl-5-oxo-2-phenyl-6-thieno[2,3-d]pyrimidinylidene)methanolate IUPAC Name: (4-methylanilino)-(4-methyl-5-oxo-2-phenylthieno[2,3-d]pyrimidin-6-ylidene)methanolate Traditional Name: (5-keto-4-methyl-2-phenyl-thieno[2,3-d]pyrimidin-6-ylidene)-(p-toluidino)methanolate Formula: C21H16N3O2S- MolecularWeight: 374.43564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=C2C(=O)C3=C(N=C(N=C3S2)C4=CC=CC=C4)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=C2C(=O)C3=C(N=C(N=C3S2)C4=CC=CC=C4)C)[O-]

InChI

InChI=1S/C21H17N3O2S/c1-12-8-10-15(11-9-12)23-20(26)18-17(25)16-13(2)22-19(24-21(16)27-18)14-6-4-3-5-7-14/h3-11,23,26H,1-2H3/p-1