1-(4-butylphenyl)-3-(1,3-dimethylpyrazol-4-yl)thiourea

Systemtic Name: 1-(4-butylphenyl)-3-(1,3-dimethylpyrazol-4-yl)thiourea Openeye Name: 1-(4-butylphenyl)-3-(1,3-dimethylpyrazol-4-yl)thiourea CAS Name: 1-(4-butylphenyl)-3-(1,3-dimethyl-4-pyrazolyl)thiourea IUPAC Name: 1-(4-butylphenyl)-3-(1,3-dimethylpyrazol-4-yl)thiourea Traditional Name: 1-(4-butylphenyl)-3-(1,3-dimethylpyrazol-4-yl)thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N4S/c1-4-5-6-13-7-9-14(10-8-13)17-16(21)18-15-11-20(3)19-12(15)2/h7-11H,4-6H2,1-3H3,(H2,17,18,21)