1-(cyclohexylmethyl)-2,4-bis(naphthalen-2-ylmethyl)-6-oxidanyl-5-(phenylmethyl)-1,2,4-triazepan-3-one

Systemtic Name: 1-(cyclohexylmethyl)-2,4-bis(naphthalen-2-ylmethyl)-6-oxidanyl-5-(phenylmethyl)-1,2,4-triazepan-3-one Openeye Name: 5-benzyl-1-(cyclohexylmethyl)-6-hydroxy-2,4-bis(2-naphthylmethyl)-1,2,4-triazepan-3-one CAS Name: 1-(cyclohexylmethyl)-6-hydroxy-2,4-bis(2-naphthalenylmethyl)-5-(phenylmethyl)-1,2,4-triazepan-3-one IUPAC Name: 5-benzyl-1-(cyclohexylmethyl)-6-hydroxy-2,4-bis(naphthalen-2-ylmethyl)-1,2,4-triazepan-3-one Traditional Name: 5-benzyl-1-(cyclohexylmethyl)-6-hydroxy-2,4-bis(2-naphthylmethyl)-1,2,4-triazepan-3-one Formula: C40H43N3O2 MolecularWeight: 597.78832

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CC(C(N(C(=O)N2CC3=CC4=CC=CC=C4C=C3)CC5=CC6=CC=CC=C6C=C5)CC7=CC=CC=C7)O

Isomeric SMILES

C1CCC(CC1)CN2CC(C(N(C(=O)N2CC3=CC4=CC=CC=C4C=C3)CC5=CC6=CC=CC=C6C=C5)CC7=CC=CC=C7)O

InChI

InChI=1S/C40H43N3O2/c44-39-29-41(26-31-13-5-2-6-14-31)43(28-33-20-22-35-16-8-10-18-37(35)24-33)40(45)42(38(39)25-30-11-3-1-4-12-30)27-32-19-21-34-15-7-9-17-36(34)23-32/h1,3-4,7-12,15-24,31,38-39,44H,2,5-6,13-14,25-29H2