1-(4-butylphenyl)-3-[3-(pyrazol-1-ylmethyl)phenyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[3-(pyrazol-1-ylmethyl)phenyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[3-(pyrazol-1-ylmethyl)phenyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[3-(1-pyrazolylmethyl)phenyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[3-(pyrazol-1-ylmethyl)phenyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[3-(pyrazol-1-ylmethyl)phenyl]thiourea Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)CN3C=CC=N3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)CN3C=CC=N3

InChI

InChI=1S/C21H24N4S/c1-2-3-6-17-9-11-19(12-10-17)23-21(26)24-20-8-4-7-18(15-20)16-25-14-5-13-22-25/h4-5,7-15H,2-3,6,16H2,1H3,(H2,23,24,26)