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

Systemtic Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(E)-(4-tert-butylphenyl)methyleneamino]-2-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(E)-(4-tert-butylphenyl)methylideneamino]-2-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(E)-(4-tert-butylbenzylidene)amino]-2-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]acetamide Formula: C28H28N4O2S MolecularWeight: 484.61252

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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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H28N4O2S/c1-19-9-5-8-12-24(19)32-26(34)22-10-6-7-11-23(22)30-27(32)35-18-25(33)31-29-17-20-13-15-21(16-14-20)28(2,3)4/h5-17H,18H2,1-4H3,(H,31,33)/b29-17+