2-[[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-2-[[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 2-[[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]methyl]-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-2-[[1-(1,3-benzothiazol-2-yl)ethyl-methyl-amino]methyl]-1,2,4-triazole-3-thione Formula: C16H19N5S2 MolecularWeight: 345.48556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)CN3C(=S)N(C=N3)CC=C

Isomeric SMILES

CC(C1=NC2=CC=CC=C2S1)N(C)CN3C(=S)N(C=N3)CC=C

InChI

InChI=1S/C16H19N5S2/c1-4-9-20-10-17-21(16(20)22)11-19(3)12(2)15-18-13-7-5-6-8-14(13)23-15/h4-8,10,12H,1,9,11H2,2-3H3