propan-2-yl 6-[3-(2-chloranylethanoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 6-[3-(2-chloranylethanoylamino)phenyl]-3,4-dimethyl-2-oxidanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 6-[3-[(2-chloroacetyl)amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-[3-[(2-chloro-1-oxoethyl)amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-[3-[(2-chloroacetyl)amino]phenyl]-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-[3-[(2-chloroacetyl)amino]phenyl]-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C18H22ClN3O4 MolecularWeight: 379.83798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)NC(=O)CCl)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)NC(=O)CCl)C(=O)OC(C)C

InChI

InChI=1S/C18H22ClN3O4/c1-10(2)26-17(24)15-11(3)22(4)18(25)21-16(15)12-6-5-7-13(8-12)20-14(23)9-19/h5-8,10,16H,9H2,1-4H3,(H,20,23)(H,21,25)