N-aminocarbonyl-2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-aminocarbonyl-2-[3-(3-chloranyl-2-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-carbamoyl-2-[3-(3-chloro-2-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-carbamoyl-2-[[3-(3-chloro-2-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-carbamoyl-2-[3-(3-chloro-2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-carbamoyl-2-[[3-(3-chloro-2-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C18H15ClN4O3S MolecularWeight: 402.8547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)N

InChI

InChI=1S/C18H15ClN4O3S/c1-10-12(19)6-4-8-14(10)23-16(25)11-5-2-3-7-13(11)21-18(23)27-9-15(24)22-17(20)26/h2-8H,9H2,1H3,(H3,20,22,24,26)