2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[1,3-benzothiazol-2-ylmethyl(methyl)amino]methyl]-4-ethyl-5-phenyl-1,2,4-triazole-3-thione Formula: C20H21N5S2 MolecularWeight: 395.54424

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C20H21N5S2/c1-3-24-19(15-9-5-4-6-10-15)22-25(20(24)26)14-23(2)13-18-21-16-11-7-8-12-17(16)27-18/h4-12H,3,13-14H2,1-2H3