N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[2-(p-tolylsulfanyl)ethyl]propanamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-[2-(p-tolylthio)ethyl]propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C20H21N3O2S/c1-14-6-8-15(9-7-14)26-13-12-21-19(24)11-10-18-22-17-5-3-2-4-16(17)20(25)23-18/h2-9H,10-13H2,1H3,(H,21,24)(H,22,23,25)