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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4S3)C

InChI

InChI=1S/C18H16N4S2/c1-12-6-5-7-14(10-12)22-13(2)20-21-18(22)23-11-17-19-15-8-3-4-9-16(15)24-17/h3-10H,11H2,1-2H3