N-[1-[(2-chlorophenyl)methyl-methyl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-1-[(3-pyrrolidin-1-ylcarbonyl-1-adamantyl)carbonyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[(2-chlorophenyl)methyl-methyl-amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-4-oxidanyl-1-[(3-pyrrolidin-1-ylcarbonyl-1-adamantyl)carbonyl]pyrrolidine-2-carboxamide Openeye Name: N-[2-[(2-chlorophenyl)methyl-methyl-amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-4-hydroxy-1-[3-(pyrrolidine-1-carbonyl)adamantane-1-carbonyl]pyrrolidine-2-carboxamide CAS Name: N-[1-[(2-chlorophenyl)methyl-methylamino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-4-hydroxy-1-[oxo-[3-[oxo(1-pyrrolidinyl)methyl]-1-adamantyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-[(2-chlorophenyl)methyl-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-4-hydroxy-1-[3-(pyrrolidine-1-carbonyl)adamantane-1-carbonyl]pyrrolidine-2-carboxamide Traditional Name: N-[2-[(2-chlorobenzyl)-methyl-amino]-2-keto-1-(2-naphthylmethyl)ethyl]-4-hydroxy-1-[3-(pyrrolidine-1-carbonyl)adamantane-1-carbonyl]pyrrolidine-2-carboxamide Formula: C42H49ClN4O5 MolecularWeight: 725.31526

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Cl)C(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4CC(CN4C(=O)C56CC7CC(C5)CC(C7)(C6)C(=O)N8CCCC8)O

Isomeric SMILES

CN(CC1=CC=CC=C1Cl)C(=O)C(CC2=CC3=CC=CC=C3C=C2)NC(=O)C4CC(CN4C(=O)C56CC7CC(C5)CC(C7)(C6)C(=O)N8CCCC8)O

InChI

InChI=1S/C42H49ClN4O5/c1-45(24-32-10-4-5-11-34(32)43)38(50)35(18-27-12-13-30-8-2-3-9-31(30)17-27)44-37(49)36-19-33(48)25-47(36)40(52)42-22-28-16-29(23-42)21-41(20-28,26-42)39(51)46-14-6-7-15-46/h2-5,8-13,17,28-29,33,35-36,48H,6-7,14-16,18-26H2,1H3,(H,44,49)