(4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyl-1,2,3-triazol-4-yl)methanone

Systemtic Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyl-1,2,3-triazol-4-yl)methanone Openeye Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyltriazol-4-yl)methanone CAS Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyl-4-triazolyl)methanone IUPAC Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyltriazol-4-yl)methanone Traditional Name: (4-cyclohexyl-1,4-diazepan-1-yl)-(1-phenethyltriazol-4-yl)methanone Formula: C22H31N5O MolecularWeight: 381.51444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN(N=N3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N2CCCN(CC2)C(=O)C3=CN(N=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H31N5O/c28-22(21-18-27(24-23-21)15-12-19-8-3-1-4-9-19)26-14-7-13-25(16-17-26)20-10-5-2-6-11-20/h1,3-4,8-9,18,20H,2,5-7,10-17H2