methyl 2-[(2S,4R)-6-bromanyl-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[(2S,4R)-6-bromanyl-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[(2S,4R)-6-bromo-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]acetate CAS Name: 2-[(2S,4R)-6-bromo-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S,4R)-6-bromo-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]acetate Traditional Name: 2-[(2S,4R)-6-bromo-2-(4-dimethylaminophenyl)-4-phenyl-2,4-dihydro-1H-quinazolin-3-yl]acetic acid methyl ester Formula: C25H26BrN3O2 MolecularWeight: 480.39684

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2NC3=C(C=C(C=C3)Br)C(N2CC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H]2NC3=C(C=C(C=C3)Br)[C@H](N2CC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H26BrN3O2/c1-28(2)20-12-9-18(10-13-20)25-27-22-14-11-19(26)15-21(22)24(17-7-5-4-6-8-17)29(25)16-23(30)31-3/h4-15,24-25,27H,16H2,1-3H3/t24-,25+/m1/s1