1-[(3-aminocarbonyl-1-adamantyl)carbonyl]-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide

Systemtic Name: 1-[(3-aminocarbonyl-1-adamantyl)carbonyl]-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-pyrrolidine-2-carboxamide Openeye Name: 1-(3-carbamoyladamantane-1-carbonyl)-4-hydroxy-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-1-(2-naphthylmethyl)-2-oxo-ethyl]pyrrolidine-2-carboxamide CAS Name: 1-[(3-carbamoyl-1-adamantyl)-oxomethyl]-4-hydroxy-N-[1-[4-(2-methoxyphenyl)-1-piperazinyl]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(3-carbamoyladamantane-1-carbonyl)-4-hydroxy-N-[1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-(3-carbamoyladamantane-1-carbonyl)-4-hydroxy-N-[2-keto-2-[4-(2-methoxyphenyl)piperazino]-1-(2-naphthylmethyl)ethyl]pyrrolidine-2-carboxamide Formula: C41H49N5O6 MolecularWeight: 707.85766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C5CC(CN5C(=O)C67CC8CC(C6)CC(C8)(C7)C(=O)N)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)C5CC(CN5C(=O)C67CC8CC(C6)CC(C8)(C7)C(=O)N)O

InChI

InChI=1S/C41H49N5O6/c1-52-35-9-5-4-8-33(35)44-12-14-45(15-13-44)37(49)32(18-26-10-11-29-6-2-3-7-30(29)17-26)43-36(48)34-19-31(47)24-46(34)39(51)41-22-27-16-28(23-41)21-40(20-27,25-41)38(42)50/h2-11,17,27-28,31-32,34,47H,12-16,18-25H2,1H3,(H2,42,50)(H,43,48)