2-methoxyethyl 3-butyl-6-[3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 3-butyl-6-[3-[(2-chloranyl-4-nitro-phenyl)carbonylamino]phenyl]-4-methyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 3-butyl-6-[3-[(2-chloro-4-nitro-benzoyl)amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-butyl-6-[3-[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-butyl-6-[3-[(2-chloro-4-nitrobenzoyl)amino]phenyl]-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-butyl-6-[3-[(2-chloro-4-nitro-benzoyl)amino]phenyl]-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C26H29ClN4O7 MolecularWeight: 544.98406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)OCCOC)C

Isomeric SMILES

CCCCN1C(=C(C(NC1=O)C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C(=O)OCCOC)C

InChI

InChI=1S/C26H29ClN4O7/c1-4-5-11-30-16(2)22(25(33)38-13-12-37-3)23(29-26(30)34)17-7-6-8-18(14-17)28-24(32)20-10-9-19(31(35)36)15-21(20)27/h6-10,14-15,23H,4-5,11-13H2,1-3H3,(H,28,32)(H,29,34)