N-[(3,4-dimethoxyphenyl)methyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-(4-methoxyphenyl)sulfonyl-2-piperazinecarboxamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonylpiperazine-2-carboxamide Traditional Name: 4-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonyl-N-veratryl-piperazine-2-carboxamide Formula: C29H33N7O6S MolecularWeight: 607.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCC4=CC(=C(C=C4)OC)OC)S(=O)(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCN(C(C3)C(=O)NCC4=CC(=C(C=C4)OC)OC)S(=O)(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C29H33N7O6S/c1-20-15-27(33-29(32-20)35-12-11-30-19-35)34-13-14-36(43(38,39)23-8-6-22(40-2)7-9-23)24(18-34)28(37)31-17-21-5-10-25(41-3)26(16-21)42-4/h5-12,15-16,19,24H,13-14,17-18H2,1-4H3,(H,31,37)