1-tert-butyl-3-[3-(5,6-dimethylbenzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]urea

Systemtic Name: 1-tert-butyl-3-[3-(5,6-dimethylbenzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]urea Openeye Name: 1-tert-butyl-3-[3-(5,6-dimethylbenzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]urea CAS Name: 1-tert-butyl-3-[3-(5,6-dimethyl-2-benzimidazolylidene)-1,2-dihydropyrazol-4-yl]urea IUPAC Name: 1-tert-butyl-3-[3-(5,6-dimethylbenzimidazol-2-ylidene)-1,2-dihydropyrazol-4-yl]urea Traditional Name: 1-tert-butyl-3-[3-(5,6-dimethylbenzimidazol-2-ylidene)-3-pyrazolin-4-yl]urea Formula: C17H22N6O MolecularWeight: 326.39618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C3C(=CNN3)NC(=O)NC(C)(C)C)N=C2C=C1C

Isomeric SMILES

CC1=CC2=NC(=C3C(=CNN3)NC(=O)NC(C)(C)C)N=C2C=C1C

InChI

InChI=1S/C17H22N6O/c1-9-6-11-12(7-10(9)2)20-15(19-11)14-13(8-18-23-14)21-16(24)22-17(3,4)5/h6-8,18,23H,1-5H3,(H2,21,22,24)