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

Systemtic Name: 2-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzothiazole Formula: C18H16N4S2 MolecularWeight: 352.47644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H16N4S2/c1-13-20-21-18(22(13)11-14-7-3-2-4-8-14)23-12-17-19-15-9-5-6-10-16(15)24-17/h2-10H,11-12H2,1H3