4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide

Systemtic Name: 4-(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide Openeye Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide CAS Name: 4-[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-2-piperazinecarboxamide IUPAC Name: 4-(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonylpiperazine-2-carboxamide Traditional Name: 4-(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)-N-[2-(4-methoxyphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperazine-2-carboxamide Formula: C28H30ClN7O5S MolecularWeight: 612.0997

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2CN(CCN2S(=O)(=O)C3=CC=C(C=C3)OC)C4=CC(=NC(=N4)N5C=CN=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2CN(CCN2S(=O)(=O)C3=CC=C(C=C3)OC)C4=CC(=NC(=N4)N5C=CN=C5)Cl

InChI

InChI=1S/C28H30ClN7O5S/c1-40-21-5-3-20(4-6-21)11-12-31-27(37)24-18-34(26-17-25(29)32-28(33-26)35-14-13-30-19-35)15-16-36(24)42(38,39)23-9-7-22(41-2)8-10-23/h3-10,13-14,17,19,24H,11-12,15-16,18H2,1-2H3,(H,31,37)