2-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)methyl-methyl-amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Openeye Name: 2-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one CAS Name: 2-[[(5-chloro-2-thiophenyl)methyl-methylamino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one IUPAC Name: 2-[[(5-chlorothiophen-2-yl)methyl-methylamino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Traditional Name: 2-[[(5-chloro-2-thienyl)methyl-methyl-amino]methyl]-6,7-dimethoxy-1H-quinazolin-4-one Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C17H18ClN3O3S/c1-21(8-10-4-5-15(18)25-10)9-16-19-12-7-14(24-3)13(23-2)6-11(12)17(22)20-16/h4-7H,8-9H2,1-3H3,(H,19,20,22)