[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate

Systemtic Name: [2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate Openeye Name: [2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl] 4-methylthieno[2,3-b]indole-2-carboxylate CAS Name: 4-methyl-2-thieno[2,3-b]indolecarboxylic acid [2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl] 4-methylthieno[2,3-b]indole-2-carboxylate Traditional Name: 4-methylthien[2,3-b]indole-2-carboxylic acid [2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl] ester Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)COC(=O)C3=CC4=C(S3)N(C5=CC=CC=C54)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)COC(=O)C3=CC4=C(S3)N(C5=CC=CC=C54)C

InChI

InChI=1S/C25H22N4O4S/c1-15-22(23(31)29(28(15)3)16-9-5-4-6-10-16)26-21(30)14-33-25(32)20-13-18-17-11-7-8-12-19(17)27(2)24(18)34-20/h4-13H,14H2,1-3H3,(H,26,30)