N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide

Systemtic Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide Openeye Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-4-(2-methyl-4-oxo-3-quinazolinyl)benzamide IUPAC Name: N-[2-(3,4-dimethylphenyl)sulfanylethyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide Traditional Name: N-[2-[(3,4-dimethylphenyl)thio]ethyl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNC(=O)C2=CC=C(C=C2)N3C(=NC4=CC=CC=C4C3=O)C)C

InChI

InChI=1S/C26H25N3O2S/c1-17-8-13-22(16-18(17)2)32-15-14-27-25(30)20-9-11-21(12-10-20)29-19(3)28-24-7-5-4-6-23(24)26(29)31/h4-13,16H,14-15H2,1-3H3,(H,27,30)