7-chloranyl-2-[[1-(4-methylsulfonylphenyl)ethylamino]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[1-(4-methylsulfonylphenyl)ethylamino]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[1-(4-methylsulfonylphenyl)ethylamino]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[1-(4-methylsulfonylphenyl)ethylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[1-(4-methylsulfonylphenyl)ethylamino]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[1-(4-mesylphenyl)ethylamino]methyl]-1H-quinazolin-4-one Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O3S/c1-11(12-3-6-14(7-4-12)26(2,24)25)20-10-17-21-16-9-13(19)5-8-15(16)18(23)22-17/h3-9,11,20H,10H2,1-2H3,(H,21,22,23)