3-(3-chloranyl-4-methyl-phenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-4-methylphenyl)-2-(prop-2-ynylthio)-4-quinazolinone IUPAC Name: 3-(3-chloro-4-methylphenyl)-2-prop-2-ynylsulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-2-(propargylthio)quinazolin-4-one Formula: C18H13ClN2OS MolecularWeight: 340.82662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#C)Cl

InChI

InChI=1S/C18H13ClN2OS/c1-3-10-23-18-20-16-7-5-4-6-14(16)17(22)21(18)13-9-8-12(2)15(19)11-13/h1,4-9,11H,10H2,2H3