1-[2-(2-methylpropyl)pyrazol-3-yl]-3-phenethyl-thiourea

Systemtic Name: 1-[2-(2-methylpropyl)pyrazol-3-yl]-3-phenethyl-thiourea Openeye Name: 1-(2-isobutylpyrazol-3-yl)-3-phenethyl-thiourea CAS Name: 1-[2-(2-methylpropyl)-3-pyrazolyl]-3-phenethylthiourea IUPAC Name: 1-[2-(2-methylpropyl)pyrazol-3-yl]-3-phenethylthiourea Traditional Name: 1-(2-isobutylpyrazol-3-yl)-3-phenethyl-thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CC=N1)NC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CC(C)CN1C(=CC=N1)NC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C16H22N4S/c1-13(2)12-20-15(9-11-18-20)19-16(21)17-10-8-14-6-4-3-5-7-14/h3-7,9,11,13H,8,10,12H2,1-2H3,(H2,17,19,21)