N,N-diethyl-4-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide

Systemtic Name: N,N-diethyl-4-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N,N-diethyl-4-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-butanamide CAS Name: N,N-diethyl-4-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N,N-diethyl-4-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N,N-diethyl-4-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]butyramide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

InChI

InChI=1S/C23H27N3O2S/c1-4-25(5-2)21(27)15-10-16-29-23-24-19-13-8-7-12-18(19)22(28)26(23)20-14-9-6-11-17(20)3/h6-9,11-14H,4-5,10,15-16H2,1-3H3