5,6-dimethyl-2-[5-(phenylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]benzimidazole

Systemtic Name: 5,6-dimethyl-2-[5-(phenylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]benzimidazole Openeye Name: 2-(5-benzylsulfanyl-1,2-dihydropyrazol-3-ylidene)-5,6-dimethyl-benzimidazole CAS Name: 5,6-dimethyl-2-[5-(phenylmethylthio)-1,2-dihydropyrazol-3-ylidene]benzimidazole IUPAC Name: 2-(5-benzylsulfanyl-1,2-dihydropyrazol-3-ylidene)-5,6-dimethylbenzimidazole Traditional Name: 2-[5-(benzylthio)-3-pyrazolin-3-ylidene]-5,6-dimethyl-benzimidazole Formula: C19H18N4S MolecularWeight: 334.43802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C3C=C(NN3)SCC4=CC=CC=C4)N=C2C=C1C

Isomeric SMILES

CC1=CC2=NC(=C3C=C(NN3)SCC4=CC=CC=C4)N=C2C=C1C

InChI

InChI=1S/C19H18N4S/c1-12-8-15-16(9-13(12)2)21-19(20-15)17-10-18(23-22-17)24-11-14-6-4-3-5-7-14/h3-10,22-23H,11H2,1-2H3