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

Systemtic Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrol-3-yl]carbonyl-piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[[1-(2-chlorophenyl)-2-methyl-5-phenyl-3-pyrrolyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-2-methyl-5-phenylpyrrole-3-carbonyl]piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[1-(2-chlorophenyl)-2-methyl-5-phenyl-pyrrole-3-carbonyl]piperazine-1-carboxamide Formula: C33H37ClN4O2 MolecularWeight: 557.12548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H37ClN4O2/c1-22-27(18-30(26-7-3-2-4-8-26)38(22)29-10-6-5-9-28(29)34)31(39)36-11-13-37(14-12-36)32(40)35-33-19-23-15-24(20-33)17-25(16-23)21-33/h2-10,18,23-25H,11-17,19-21H2,1H3,(H,35,40)