N-(1-adamantyl)-4-[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[1-(3-methoxyphenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide Formula: C35H42N4O4 MolecularWeight: 582.73238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC(=CC=C2)OC)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)NC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C=C(N1C2=CC(=CC=C2)OC)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C35H42N4O4/c1-23-31(19-32(27-7-9-29(42-2)10-8-27)39(23)28-5-4-6-30(18-28)43-3)33(40)37-11-13-38(14-12-37)34(41)36-35-20-24-15-25(21-35)17-26(16-24)22-35/h4-10,18-19,24-26H,11-17,20-22H2,1-3H3,(H,36,41)