N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethanamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethanamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxo-acetamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-2-[4-(3,4-dimethylphenyl)-1-piperazinyl]-2-oxoacetamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-2-[4-(3,4-dimethylphenyl)piperazin-1-yl]-2-oxoacetamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-2-[4-(3,4-dimethylphenyl)piperazino]-2-keto-acetamide Formula: C28H33N7O3 MolecularWeight: 515.60672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CCN(CC2)C(=O)C(=O)NC3=CC(=NC(=N3)C4=CC=CC=C4)NCCNC(=O)C)C

InChI

InChI=1S/C28H33N7O3/c1-19-9-10-23(17-20(19)2)34-13-15-35(16-14-34)28(38)27(37)33-25-18-24(30-12-11-29-21(3)36)31-26(32-25)22-7-5-4-6-8-22/h4-10,17-18H,11-16H2,1-3H3,(H,29,36)(H2,30,31,32,33,37)