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

Systemtic Name: 5,6-dimethyl-2-[5-(pyridin-3-ylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]benzimidazole Openeye Name: 5,6-dimethyl-2-[5-(3-pyridylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]benzimidazole CAS Name: 5,6-dimethyl-2-[5-(3-pyridinylmethylthio)-1,2-dihydropyrazol-3-ylidene]benzimidazole IUPAC Name: 5,6-dimethyl-2-[5-(pyridin-3-ylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]benzimidazole Traditional Name: 5,6-dimethyl-2-[5-(3-pyridylmethylthio)-3-pyrazolin-3-ylidene]benzimidazole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N5S/c1-11-6-14-15(7-12(11)2)21-18(20-14)16-8-17(23-22-16)24-10-13-4-3-5-19-9-13/h3-9,22-23H,10H2,1-2H3