[3-[[4-(3-oxidanylpropyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-thiophen-3-yl-methanone

Systemtic Name: [3-[[4-(3-oxidanylpropyl)-1,2,3-triazol-1-yl]methyl]piperidin-1-yl]-thiophen-3-yl-methanone Openeye Name: [3-[[4-(3-hydroxypropyl)triazol-1-yl]methyl]-1-piperidyl]-(3-thienyl)methanone CAS Name: [3-[[4-(3-hydroxypropyl)-1-triazolyl]methyl]-1-piperidinyl]-(3-thiophenyl)methanone IUPAC Name: [3-[[4-(3-hydroxypropyl)triazol-1-yl]methyl]piperidin-1-yl]-thiophen-3-ylmethanone Traditional Name: [3-[[4-(3-hydroxypropyl)triazol-1-yl]methyl]piperidino]-(3-thienyl)methanone Formula: C16H22N4O2S MolecularWeight: 334.43648

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CSC=C2)CN3C=C(N=N3)CCCO

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CSC=C2)CN3C=C(N=N3)CCCO

InChI

InChI=1S/C16H22N4O2S/c21-7-2-4-15-11-20(18-17-15)10-13-3-1-6-19(9-13)16(22)14-5-8-23-12-14/h5,8,11-13,21H,1-4,6-7,9-10H2