1-(4-butylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea CAS Name: 1-(4-butylphenyl)-3-(1,3,5-trimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)thiourea Formula: C17H24N4S MolecularWeight: 316.46426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(N(N=C2C)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=C(N(N=C2C)C)C

InChI

InChI=1S/C17H24N4S/c1-5-6-7-14-8-10-15(11-9-14)18-17(22)19-16-12(2)20-21(4)13(16)3/h8-11H,5-7H2,1-4H3,(H2,18,19,22)