2-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(E)-(2-methylphenyl)methylideneamino]ethanamide

Systemtic Name: 2-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(E)-(2-methylphenyl)methylideneamino]ethanamide Openeye Name: 2-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(E)-o-tolylmethyleneamino]acetamide CAS Name: 2-[[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-[(E)-(2-methylphenyl)methylideneamino]acetamide IUPAC Name: 2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(E)-(2-methylphenyl)methylideneamino]acetamide Traditional Name: 2-[[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]thio]-N-[(E)-(2-methylbenzylidene)amino]acetamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1/C=N/NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H22N4O3S/c1-17-7-3-4-8-18(17)15-26-28-23(30)16-33-25-27-22-10-6-5-9-21(22)24(31)29(25)19-11-13-20(32-2)14-12-19/h3-15H,16H2,1-2H3,(H,28,30)/b26-15+