2-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole

Systemtic Name: 2-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methylsulfanyl]-1,3-benzothiazole Openeye Name: 2-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-1,3-benzothiazole CAS Name: 2-[[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole IUPAC Name: 2-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-1,3-benzothiazole Traditional Name: 2-[[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]methylthio]-1,3-benzothiazole Formula: C18H16N4S3 MolecularWeight: 384.54144

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N4S3/c1-23-17-21-20-16(22(17)11-13-7-3-2-4-8-13)12-24-18-19-14-9-5-6-10-15(14)25-18/h2-10H,11-12H2,1H3