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

Systemtic Name: 2-[5-(cyclopropylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]-5,6-dimethyl-benzimidazole Openeye Name: 2-[5-(cyclopropylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]-5,6-dimethyl-benzimidazole CAS Name: 2-[5-(cyclopropylmethylthio)-1,2-dihydropyrazol-3-ylidene]-5,6-dimethylbenzimidazole IUPAC Name: 2-[5-(cyclopropylmethylsulfanyl)-1,2-dihydropyrazol-3-ylidene]-5,6-dimethylbenzimidazole Traditional Name: 2-[5-(cyclopropylmethylthio)-3-pyrazolin-3-ylidene]-5,6-dimethyl-benzimidazole Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C3C=C(NN3)SCC4CC4)N=C2C=C1C

Isomeric SMILES

CC1=CC2=NC(=C3C=C(NN3)SCC4CC4)N=C2C=C1C

InChI

InChI=1S/C16H18N4S/c1-9-5-12-13(6-10(9)2)18-16(17-12)14-7-15(20-19-14)21-8-11-3-4-11/h5-7,11,19-20H,3-4,8H2,1-2H3