1-(4-butylphenyl)-3-[(1,5-dimethylpyrazol-3-yl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(1,5-dimethylpyrazol-3-yl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(1,5-dimethylpyrazol-3-yl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(1,5-dimethyl-3-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(1,5-dimethylpyrazol-3-yl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(1,5-dimethylpyrazol-3-yl)methyl]thiourea Formula: C17H24N4S MolecularWeight: 316.46426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=NN(C(=C2)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=NN(C(=C2)C)C

InChI

InChI=1S/C17H24N4S/c1-4-5-6-14-7-9-15(10-8-14)19-17(22)18-12-16-11-13(2)21(3)20-16/h7-11H,4-6,12H2,1-3H3,(H2,18,19,22)