propan-2-yl 4-[4-[(2,6-dimethylphenyl)carbamoyl]-3-methyl-piperazin-1-yl]carbonyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-[4-[(2,6-dimethylphenyl)carbamoyl]-3-methyl-piperazin-1-yl]carbonyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-[4-[(2,6-dimethylphenyl)carbamoyl]-3-methyl-piperazine-1-carbonyl]-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-[(2,6-dimethylanilino)-oxomethyl]-3-methyl-1-piperazinyl]-oxomethyl]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-[(2,6-dimethylphenyl)carbamoyl]-3-methylpiperazine-1-carbonyl]-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[4-[(2,6-dimethylphenyl)carbamoyl]-3-methyl-piperazine-1-carbonyl]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid isopropyl ester Formula: C30H35N5O4 MolecularWeight: 529.63

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=C(C=CC=C2C)C)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)C)C(=O)OC(C)C

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=C(C=CC=C2C)C)C(=O)C3=C(C(=NC(=N3)C4=CC=CC=C4)C)C(=O)OC(C)C

InChI

InChI=1S/C30H35N5O4/c1-18(2)39-29(37)24-22(6)31-27(23-13-8-7-9-14-23)32-26(24)28(36)34-15-16-35(21(5)17-34)30(38)33-25-19(3)11-10-12-20(25)4/h7-14,18,21H,15-17H2,1-6H3,(H,33,38)