N-(3-bromophenyl)-6,7-diethoxy-2-(methylsulfonylmethyl)quinazolin-4-amine

Systemtic Name: N-(3-bromophenyl)-6,7-diethoxy-2-(methylsulfonylmethyl)quinazolin-4-amine Openeye Name: N-(3-bromophenyl)-6,7-diethoxy-2-(methylsulfonylmethyl)quinazolin-4-amine CAS Name: N-(3-bromophenyl)-6,7-diethoxy-2-(methylsulfonylmethyl)-4-quinazolinamine IUPAC Name: N-(3-bromophenyl)-6,7-diethoxy-2-(methylsulfonylmethyl)quinazolin-4-amine Traditional Name: (3-bromophenyl)-[6,7-diethoxy-2-(mesylmethyl)quinazolin-4-yl]amine Formula: C20H22BrN3O4S MolecularWeight: 480.37538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=NC(=N2)CS(=O)(=O)C)NC3=CC(=CC=C3)Br)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=NC(=N2)CS(=O)(=O)C)NC3=CC(=CC=C3)Br)OCC

InChI

InChI=1S/C20H22BrN3O4S/c1-4-27-17-10-15-16(11-18(17)28-5-2)23-19(12-29(3,25)26)24-20(15)22-14-8-6-7-13(21)9-14/h6-11H,4-5,12H2,1-3H3,(H,22,23,24)