1-[3-[[4-(2-azanylpropan-2-yl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-2-thiophen-3-yl-ethanone

Systemtic Name: 1-[3-[[4-(2-azanylpropan-2-yl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-2-thiophen-3-yl-ethanone Openeye Name: 1-[3-[[4-(1-amino-1-methyl-ethyl)triazol-1-yl]methyl]-1-piperidyl]-2-(3-thienyl)ethanone CAS Name: 1-[3-[[4-(2-aminopropan-2-yl)-1-triazolyl]methyl]-1-piperidinyl]-2-(3-thiophenyl)ethanone IUPAC Name: 1-[3-[[4-(2-aminopropan-2-yl)triazol-1-yl]methyl]piperidin-1-yl]-2-thiophen-3-ylethanone Traditional Name: 1-[3-[[4-(1-amino-1-methyl-ethyl)triazol-1-yl]methyl]piperidino]-2-(3-thienyl)ethanone Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CN(N=N1)CC2CCCN(C2)C(=O)CC3=CSC=C3)N

Isomeric SMILES

CC(C)(C1=CN(N=N1)CC2CCCN(C2)C(=O)CC3=CSC=C3)N

InChI

InChI=1S/C17H25N5OS/c1-17(2,18)15-11-22(20-19-15)10-14-4-3-6-21(9-14)16(23)8-13-5-7-24-12-13/h5,7,11-12,14H,3-4,6,8-10,18H2,1-2H3