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

Systemtic Name: N-[(E)-(4-ethoxy-3-methoxy-phenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(E)-(4-ethoxy-3-methoxy-phenyl)methyleneamino]-2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(E)-(4-ethoxy-3-methoxyphenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(E)-(4-ethoxy-3-methoxy-benzylidene)amino]-2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]acetamide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4C)OC

InChI

InChI=1S/C27H26N4O4S/c1-4-35-23-14-13-19(15-24(23)34-3)16-28-30-25(32)17-36-27-29-21-11-7-6-10-20(21)26(33)31(27)22-12-8-5-9-18(22)2/h5-16H,4,17H2,1-3H3,(H,30,32)/b28-16+