1-(4-butylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[(1-methyl-4-pyrazolyl)methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[(1-methylpyrazol-4-yl)methyl]thiourea Formula: C16H22N4S MolecularWeight: 302.43768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CN(N=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CN(N=C2)C

InChI

InChI=1S/C16H22N4S/c1-3-4-5-13-6-8-15(9-7-13)19-16(21)17-10-14-11-18-20(2)12-14/h6-9,11-12H,3-5,10H2,1-2H3,(H2,17,19,21)