1-(3,5-dimethylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea CAS Name: 1-(3,5-dimethylphenyl)-3-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]thiourea Formula: C18H26N4S MolecularWeight: 330.49084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N4S/c1-13-9-14(2)11-15(10-13)20-17(23)21-16(18(3,4)5)12-22-8-6-7-19-22/h6-11,16H,12H2,1-5H3,(H2,20,21,23)