N-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-quinazolin-4-amine

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-quinazolin-4-amine Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxy-quinazolin-4-amine CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-6,7-dimethoxy-4-quinazolinamine IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-6,7-dimethoxyquinazolin-4-amine Traditional Name: 2-[(4-chlorophenyl)thio]ethyl-(6,7-dimethoxyquinazolin-4-yl)amine Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NCCSC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NCCSC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C18H18ClN3O2S/c1-23-16-9-14-15(10-17(16)24-2)21-11-22-18(14)20-7-8-25-13-5-3-12(19)4-6-13/h3-6,9-11H,7-8H2,1-2H3,(H,20,21,22)