N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[[3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]methylsulfanyl]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[[3-(m-tolyl)-4-oxo-quinazolin-2-yl]methylsulfanyl]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[[3-(3-methylphenyl)-4-oxo-2-quinazolinyl]methylthio]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[[3-(3-methylphenyl)-4-oxoquinazolin-2-yl]methylsulfanyl]acetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[[4-keto-3-(m-tolyl)quinazolin-2-yl]methylthio]acetamide Formula: C29H27N5O3S MolecularWeight: 525.62138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NC3=CC=CC=C3C2=O)CSCC(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NC3=CC=CC=C3C2=O)CSCC(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C29H27N5O3S/c1-19-10-9-13-22(16-19)33-25(30-24-15-8-7-14-23(24)28(33)36)17-38-18-26(35)31-27-20(2)32(3)34(29(27)37)21-11-5-4-6-12-21/h4-16H,17-18H2,1-3H3,(H,31,35)