4-(2-imidazol-1-ylpyrimidin-4-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide

Systemtic Name: 4-(2-imidazol-1-ylpyrimidin-4-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide Openeye Name: 4-(2-imidazol-1-ylpyrimidin-4-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide CAS Name: 4-[2-(1-imidazolyl)-4-pyrimidinyl]-N-[(2-methoxyphenyl)methyl]-1-(4-methoxyphenyl)sulfonyl-2-piperazinecarboxamide IUPAC Name: 4-(2-imidazol-1-ylpyrimidin-4-yl)-N-[(2-methoxyphenyl)methyl]-1-(4-methoxyphenyl)sulfonylpiperazine-2-carboxamide Traditional Name: 4-(2-imidazol-1-ylpyrimidin-4-yl)-1-(4-methoxyphenyl)sulfonyl-N-o-anisyl-piperazine-2-carboxamide Formula: C27H29N7O5S MolecularWeight: 563.62806

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NCC3=CC=CC=C3OC)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2C(=O)NCC3=CC=CC=C3OC)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C27H29N7O5S/c1-38-21-7-9-22(10-8-21)40(36,37)34-16-15-32(25-11-12-29-27(31-25)33-14-13-28-19-33)18-23(34)26(35)30-17-20-5-3-4-6-24(20)39-2/h3-14,19,23H,15-18H2,1-2H3,(H,30,35)