1-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]-3-(3-methylbutyl)thiourea

Systemtic Name: 1-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]carbonylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[[3,5-dimethyl-1-(p-tolylmethyl)pyrazole-4-carbonyl]amino]-3-isopentyl-thiourea CAS Name: 1-[[[3,5-dimethyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]-oxomethyl]amino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[[3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carbonyl]amino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[[3,5-dimethyl-1-(4-methylbenzyl)pyrazole-4-carbonyl]amino]-3-isoamyl-thiourea Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NNC(=S)NCCC(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NNC(=S)NCCC(C)C)C

InChI

InChI=1S/C20H29N5OS/c1-13(2)10-11-21-20(27)23-22-19(26)18-15(4)24-25(16(18)5)12-17-8-6-14(3)7-9-17/h6-9,13H,10-12H2,1-5H3,(H,22,26)(H2,21,23,27)