(5-methyl-2-phenyl-1,2,3-triazol-4-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-methyl-2-phenyl-1,2,3-triazol-4-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(5-methyl-2-phenyl-triazol-4-yl)methanone CAS Name: (5-methyl-2-phenyl-4-triazolyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(5-methyl-2-phenyltriazol-4-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(5-methyl-2-phenyl-triazol-4-yl)methanone Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)N2CCCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(N=C1C(=O)N2CCCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O/c1-18-21(24-27(23-18)20-11-6-3-7-12-20)22(28)26-14-8-13-25(15-16-26)17-19-9-4-2-5-10-19/h2-7,9-12H,8,13-17H2,1H3