6-chloranyl-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[methyl-[4-(methylthio)benzyl]amino]methyl]-1H-quinazolin-4-one Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C18H18ClN3OS/c1-22(10-12-3-6-14(24-2)7-4-12)11-17-20-16-8-5-13(19)9-15(16)18(23)21-17/h3-9H,10-11H2,1-2H3,(H,20,21,23)