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

Systemtic Name: 2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]methyl]-1,3-benzothiazole Formula: C20H20N4S2 MolecularWeight: 380.5296

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)C4=CC(=CC=C4)C

Isomeric SMILES

CCCN1C(=NN=C1SCC2=NC3=CC=CC=C3S2)C4=CC(=CC=C4)C

InChI

InChI=1S/C20H20N4S2/c1-3-11-24-19(15-8-6-7-14(2)12-15)22-23-20(24)25-13-18-21-16-9-4-5-10-17(16)26-18/h4-10,12H,3,11,13H2,1-2H3