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

Systemtic Name: N,N-diethyl-4-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-butanamide Openeye Name: N,N-diethyl-4-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-butanamide CAS Name: N,N-diethyl-4-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]butanamide IUPAC Name: N,N-diethyl-4-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylbutanamide Traditional Name: N,N-diethyl-4-[[4-keto-3-(p-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=C(C=C3)C

Isomeric SMILES

CCN(CC)C(=O)CCCSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C

InChI

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