2-(2,4-dichlorophenyl)-5-methyl-1-(4-phenylmethoxyphenyl)-N-piperidin-1-yl-imidazole-4-carboxamide; naphthalene-1,5-disulfonic acid

Systemtic Name: 2-(2,4-dichlorophenyl)-5-methyl-1-(4-phenylmethoxyphenyl)-N-piperidin-1-yl-imidazole-4-carboxamide; naphthalene-1,5-disulfonic acid Openeye Name: 1-(4-benzyloxyphenyl)-2-(2,4-dichlorophenyl)-5-methyl-N-(1-piperidyl)imidazole-4-carboxamide; naphthalene-1,5-disulfonic acid CAS Name: 2-(2,4-dichlorophenyl)-5-methyl-1-(4-phenylmethoxyphenyl)-N-(1-piperidinyl)-4-imidazolecarboxamide; naphthalene-1,5-disulfonic acid IUPAC Name: 2-(2,4-dichlorophenyl)-5-methyl-1-(4-phenylmethoxyphenyl)-N-piperidin-1-ylimidazole-4-carboxamide; naphthalene-1,5-disulfonic acid Traditional Name: 1-(4-benzoxyphenyl)-2-(2,4-dichlorophenyl)-5-methyl-N-piperidino-imidazole-4-carboxamide; naphthalene-1,5-disulfonic acid Formula: C39H36Cl2N4O8S2 MolecularWeight: 823.76114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)NN5CCCCC5.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O

Isomeric SMILES

CC1=C(N=C(N1C2=CC=C(C=C2)OCC3=CC=CC=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)NN5CCCCC5.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C29H28Cl2N4O2.C10H8O6S2/c1-20-27(29(36)33-34-16-6-3-7-17-34)32-28(25-15-10-22(30)18-26(25)31)35(20)23-11-13-24(14-12-23)37-19-21-8-4-2-5-9-21;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h2,4-5,8-15,18H,3,6-7,16-17,19H2,1H3,(H,33,36);1-6H,(H,11,12,13)(H,14,15,16)