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

Systemtic Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(E)-(4-dimethylaminophenyl)methyleneamino]-2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(E)-[4-(dimethylamino)benzylidene]amino]-2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]acetamide Formula: C26H25N5O2S MolecularWeight: 471.574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NN=CC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N/N=C/C4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C26H25N5O2S/c1-18-8-4-7-11-23(18)31-25(33)21-9-5-6-10-22(21)28-26(31)34-17-24(32)29-27-16-19-12-14-20(15-13-19)30(2)3/h4-16H,17H2,1-3H3,(H,29,32)/b27-16+