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

Systemtic Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-5-(4-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperazine-1-carboxamide Formula: C34H39ClN4O3 MolecularWeight: 587.15146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=CC=C2Cl)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=C2Cl)C3=CC=C(C=C3)OC)C(=O)N4CCN(CC4)C(=O)NC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C34H39ClN4O3/c1-22-28(18-31(26-7-9-27(42-2)10-8-26)39(22)30-6-4-3-5-29(30)35)32(40)37-11-13-38(14-12-37)33(41)36-34-19-23-15-24(20-34)17-25(16-23)21-34/h3-10,18,23-25H,11-17,19-21H2,1-2H3,(H,36,41)