1-[3-[[4-(aminomethyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-2-methyl-2-phenylazanyl-propan-1-one

Systemtic Name: 1-[3-[[4-(aminomethyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-2-methyl-2-phenylazanyl-propan-1-one Openeye Name: 1-[3-[[4-(aminomethyl)triazol-1-yl]methyl]-1-piperidyl]-2-anilino-2-methyl-propan-1-one CAS Name: 1-[3-[[4-(aminomethyl)-1-triazolyl]methyl]-1-piperidinyl]-2-anilino-2-methyl-1-propanone IUPAC Name: 1-[3-[[4-(aminomethyl)triazol-1-yl]methyl]piperidin-1-yl]-2-anilino-2-methylpropan-1-one Traditional Name: 1-[3-[[4-(aminomethyl)triazol-1-yl]methyl]piperidino]-2-anilino-2-methyl-propan-1-one Formula: C19H28N6O MolecularWeight: 356.46522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N1CCCC(C1)CN2C=C(N=N2)CN)NC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)N1CCCC(C1)CN2C=C(N=N2)CN)NC3=CC=CC=C3

InChI

InChI=1S/C19H28N6O/c1-19(2,21-16-8-4-3-5-9-16)18(26)24-10-6-7-15(12-24)13-25-14-17(11-20)22-23-25/h3-5,8-9,14-15,21H,6-7,10-13,20H2,1-2H3