N-(3-chloranyl-2-methyl-phenyl)-2-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]sulfanyl-acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]thio]acetamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)CSC(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)CS[C@H](C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C19H18ClN3O2S/c1-11-14(20)7-5-9-15(11)21-17(24)10-26-12(2)18-22-16-8-4-3-6-13(16)19(25)23-18/h3-9,12H,10H2,1-2H3,(H,21,24)(H,22,23,25)/t12-/m1/s1