1-(4-butylphenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[[4-(1-pyrazolyl)phenyl]methyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[(4-pyrazol-1-ylphenyl)methyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-(4-pyrazol-1-ylbenzyl)thiourea Formula: C21H24N4S MolecularWeight: 364.50706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NCC2=CC=C(C=C2)N3C=CC=N3

InChI

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