N-(3-chloranyl-2-methyl-phenyl)-3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-3-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-2-methylphenyl)-3-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-3-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-3-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CCSC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C19H18ClN3O2S/c1-12-14(20)7-5-9-15(12)21-17(24)10-11-26-19-22-16-8-4-3-6-13(16)18(25)23(19)2/h3-9H,10-11H2,1-2H3,(H,21,24)