1-(5-chloranyl-2-methyl-phenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea

Systemtic Name: 1-(5-chloranyl-2-methyl-phenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea Openeye Name: 1-(5-chloro-2-methyl-phenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea CAS Name: 1-(5-chloro-2-methylphenyl)-3-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]thiourea IUPAC Name: 1-(5-chloro-2-methylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)thiourea Traditional Name: 1-(5-chloro-2-methyl-phenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea Formula: C17H23ClN4S MolecularWeight: 350.90932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=S)NC(CN2C=CC=N2)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=S)NC(CN2C=CC=N2)C(C)(C)C

InChI

InChI=1S/C17H23ClN4S/c1-12-6-7-13(18)10-14(12)20-16(23)21-15(17(2,3)4)11-22-9-5-8-19-22/h5-10,15H,11H2,1-4H3,(H2,20,21,23)