3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-4-amine

Systemtic Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-4-amine Openeye Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-isopropylsulfanyl-1,2,4-triazol-4-amine CAS Name: 3-(1,3-benzothiazol-2-ylmethylthio)-5-(propan-2-ylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-propan-2-ylsulfanyl-1,2,4-triazol-4-amine Traditional Name: [3-(1,3-benzothiazol-2-ylmethylthio)-5-(isopropylthio)-1,2,4-triazol-4-yl]amine Formula: C13H15N5S3 MolecularWeight: 337.4867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1N)SCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)SC1=NN=C(N1N)SCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H15N5S3/c1-8(2)20-13-17-16-12(18(13)14)19-7-11-15-9-5-3-4-6-10(9)21-11/h3-6,8H,7,14H2,1-2H3