(4-cyclohexyl-1,4-diazepan-1-yl)-[1-(naphthalen-1-ylmethyl)-1,2,3-triazol-4-yl]methanone

Systemtic Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[1-(naphthalen-1-ylmethyl)-1,2,3-triazol-4-yl]methanone Openeye Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[1-(1-naphthylmethyl)triazol-4-yl]methanone CAS Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[1-(1-naphthalenylmethyl)-4-triazolyl]methanone IUPAC Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[1-(naphthalen-1-ylmethyl)triazol-4-yl]methanone Traditional Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[1-(1-naphthylmethyl)triazol-4-yl]methanone Formula: C25H31N5O MolecularWeight: 417.54654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN(N=N3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN(N=N3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H31N5O/c31-25(29-15-7-14-28(16-17-29)22-11-2-1-3-12-22)24-19-30(27-26-24)18-21-10-6-9-20-8-4-5-13-23(20)21/h4-6,8-10,13,19,22H,1-3,7,11-12,14-18H2