2-methoxyethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-3-butyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-3-butyl-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[4-[[(3-bromoanilino)-oxomethyl]amino]phenyl]-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-3-butyl-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[4-[(3-bromophenyl)carbamoylamino]phenyl]-3-butyl-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C26H31BrN4O5 MolecularWeight: 559.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Br)C(=O)OCCOC)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC=C3)Br)C(=O)OCCOC)C

InChI

InChI=1S/C26H31BrN4O5/c1-4-5-13-31-17(2)22(24(32)36-15-14-35-3)23(30-26(31)34)18-9-11-20(12-10-18)28-25(33)29-21-8-6-7-19(27)16-21/h6-12,16,23H,4-5,13-15H2,1-3H3,(H,30,34)(H2,28,29,33)