1-(4-butan-2-ylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea

Systemtic Name: 1-(4-butan-2-ylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-yl-butan-2-yl)thiourea Openeye Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-[3,3-dimethyl-1-(1-pyrazolyl)butan-2-yl]thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(3,3-dimethyl-1-pyrazol-1-ylbutan-2-yl)thiourea Traditional Name: 1-[2,2-dimethyl-1-(pyrazol-1-ylmethyl)propyl]-3-(4-sec-butylphenyl)thiourea Formula: C20H30N4S MolecularWeight: 358.544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N4S/c1-6-15(2)16-8-10-17(11-9-16)22-19(25)23-18(20(3,4)5)14-24-13-7-12-21-24/h7-13,15,18H,6,14H2,1-5H3,(H2,22,23,25)