1-(tert-butylamino)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea

Systemtic Name: 1-(tert-butylamino)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Openeye Name: 1-(tert-butylamino)-3-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(tert-butylamino)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]thiourea IUPAC Name: 1-(tert-butylamino)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]thiourea Traditional Name: 1-(tert-butylamino)-3-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]thiourea Formula: C18H27N5S MolecularWeight: 345.50548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=S)NNC(C)(C)C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=S)NNC(C)(C)C)C

InChI

InChI=1S/C18H27N5S/c1-12-9-7-8-10-15(12)11-23-14(3)16(13(2)21-23)19-17(24)20-22-18(4,5)6/h7-10,22H,11H2,1-6H3,(H2,19,20,24)