N-[[5-(2-chloranylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-pyridin-3-yl-methanamine

Systemtic Name: N-[[5-(2-chloranylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-pyridin-3-yl-methanamine Openeye Name: N-[[4-allyl-5-(2-chloroallylsulfanyl)-1,2,4-triazol-3-yl]methyl]-N-methyl-1-(3-pyridyl)methanamine CAS Name: N-[[5-(2-chloroprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-(3-pyridinyl)methanamine IUPAC Name: N-[[5-(2-chloroprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-pyridin-3-ylmethanamine Traditional Name: [4-allyl-5-(2-chloroallylthio)-1,2,4-triazol-3-yl]methyl-methyl-(3-pyridylmethyl)amine Formula: C16H20ClN5S MolecularWeight: 349.8815

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=CC=C1)CC2=NN=C(N2CC=C)SCC(=C)Cl

Isomeric SMILES

CN(CC1=CN=CC=C1)CC2=NN=C(N2CC=C)SCC(=C)Cl

InChI

InChI=1S/C16H20ClN5S/c1-4-8-22-15(19-20-16(22)23-12-13(2)17)11-21(3)10-14-6-5-7-18-9-14/h4-7,9H,1-2,8,10-12H2,3H3