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

Systemtic Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-(phenoxymethyl)-1,2,4-triazol-4-amine Openeye Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-(phenoxymethyl)-1,2,4-triazol-4-amine CAS Name: 3-(1,3-benzothiazol-2-ylmethylthio)-5-(phenoxymethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-(1,3-benzothiazol-2-ylmethylsulfanyl)-5-(phenoxymethyl)-1,2,4-triazol-4-amine Traditional Name: [3-(1,3-benzothiazol-2-ylmethylthio)-5-(phenoxymethyl)-1,2,4-triazol-4-yl]amine Formula: C17H15N5OS2 MolecularWeight: 369.4639

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NN=C(N2N)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H15N5OS2/c18-22-15(10-23-12-6-2-1-3-7-12)20-21-17(22)24-11-16-19-13-8-4-5-9-14(13)25-16/h1-9H,10-11,18H2