N-[3-chloranyl-4-(phenylsulfonyl)phenyl]-6,7-dimethoxy-quinazolin-4-amine

Systemtic Name: N-[3-chloranyl-4-(phenylsulfonyl)phenyl]-6,7-dimethoxy-quinazolin-4-amine Openeye Name: N-[4-(benzenesulfonyl)-3-chloro-phenyl]-6,7-dimethoxy-quinazolin-4-amine CAS Name: N-[4-(benzenesulfonyl)-3-chlorophenyl]-6,7-dimethoxy-4-quinazolinamine IUPAC Name: N-[4-(benzenesulfonyl)-3-chlorophenyl]-6,7-dimethoxyquinazolin-4-amine Traditional Name: (4-besyl-3-chloro-phenyl)-(6,7-dimethoxyquinazolin-4-yl)amine Formula: C22H18ClN3O4S MolecularWeight: 455.91402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)S(=O)(=O)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)S(=O)(=O)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C22H18ClN3O4S/c1-29-19-11-16-18(12-20(19)30-2)24-13-25-22(16)26-14-8-9-21(17(23)10-14)31(27,28)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,24,25,26)