methyl 4-[2-[1-[(2-bromophenyl)carbamoyl-phenethyl-amino]ethyl]-4-oxidanylidene-quinazolin-3-yl]butanoate

Systemtic Name: methyl 4-[2-[1-[(2-bromophenyl)carbamoyl-phenethyl-amino]ethyl]-4-oxidanylidene-quinazolin-3-yl]butanoate Openeye Name: methyl 4-[2-[1-[(2-bromophenyl)carbamoyl-phenethyl-amino]ethyl]-4-oxo-quinazolin-3-yl]butanoate CAS Name: 4-[2-[1-[[(2-bromoanilino)-oxomethyl]-phenethylamino]ethyl]-4-oxo-3-quinazolinyl]butanoic acid methyl ester IUPAC Name: methyl 4-[2-[1-[(2-bromophenyl)carbamoyl-phenethylamino]ethyl]-4-oxoquinazolin-3-yl]butanoate Traditional Name: 4-[2-[1-[(2-bromophenyl)carbamoyl-phenethyl-amino]ethyl]-4-keto-quinazolin-3-yl]butyric acid methyl ester Formula: C30H31BrN4O4 MolecularWeight: 591.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC)N(CCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=O)N1CCCC(=O)OC)N(CCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C30H31BrN4O4/c1-21(28-32-25-15-8-6-13-23(25)29(37)35(28)19-10-17-27(36)39-2)34(20-18-22-11-4-3-5-12-22)30(38)33-26-16-9-7-14-24(26)31/h3-9,11-16,21H,10,17-20H2,1-2H3,(H,33,38)