N-[[5-(2-chloranylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-thiophen-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-thiophen-3-yl-methanamine Openeye Name: N-[[4-allyl-5-(2-chloroallylsulfanyl)-1,2,4-triazol-3-yl]methyl]-N-methyl-1-(3-thienyl)methanamine CAS Name: N-[[5-(2-chloroprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-(3-thiophenyl)methanamine IUPAC Name: N-[[5-(2-chloroprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-N-methyl-1-thiophen-3-ylmethanamine Traditional Name: [4-allyl-5-(2-chloroallylthio)-1,2,4-triazol-3-yl]methyl-methyl-(3-thenyl)amine Formula: C15H19ClN4S2 MolecularWeight: 354.92116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN4S2/c1-4-6-20-14(17-18-15(20)22-10-12(2)16)9-19(3)8-13-5-7-21-11-13/h4-5,7,11H,1-2,6,8-10H2,3H3