N-[4-[[(E)-2-(4-bromophenyl)ethenyl]sulfonylmethyl]phenyl]-6,7-dimethoxy-quinazolin-4-amine

Systemtic Name: N-[4-[[(E)-2-(4-bromophenyl)ethenyl]sulfonylmethyl]phenyl]-6,7-dimethoxy-quinazolin-4-amine Openeye Name: N-[4-[[(E)-2-(4-bromophenyl)vinyl]sulfonylmethyl]phenyl]-6,7-dimethoxy-quinazolin-4-amine CAS Name: N-[4-[[(E)-2-(4-bromophenyl)ethenyl]sulfonylmethyl]phenyl]-6,7-dimethoxy-4-quinazolinamine IUPAC Name: N-[4-[[(E)-2-(4-bromophenyl)ethenyl]sulfonylmethyl]phenyl]-6,7-dimethoxyquinazolin-4-amine Traditional Name: [4-[[(E)-2-(4-bromophenyl)vinyl]sulfonylmethyl]phenyl]-(6,7-dimethoxyquinazolin-4-yl)amine Formula: C25H22BrN3O4S MolecularWeight: 540.42888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)CS(=O)(=O)C=CC4=CC=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)CS(=O)(=O)/C=C/C4=CC=C(C=C4)Br)OC

InChI

InChI=1S/C25H22BrN3O4S/c1-32-23-13-21-22(14-24(23)33-2)27-16-28-25(21)29-20-9-5-18(6-10-20)15-34(30,31)12-11-17-3-7-19(26)8-4-17/h3-14,16H,15H2,1-2H3,(H,27,28,29)/b12-11+