3-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-benzylsulfanyl-1,2,4-triazol-4-amine CAS Name: 3-[(1,3-benzothiazol-2-ylthio)methyl]-5-(phenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanylmethyl)-5-benzylsulfanyl-1,2,4-triazol-4-amine Traditional Name: [3-[(1,3-benzothiazol-2-ylthio)methyl]-5-(benzylthio)-1,2,4-triazol-4-yl]amine Formula: C17H15N5S3 MolecularWeight: 385.5295

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2N)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2N)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H15N5S3/c18-22-15(11-24-17-19-13-8-4-5-9-14(13)25-17)20-21-16(22)23-10-12-6-2-1-3-7-12/h1-9H,10-11,18H2