1-(2-methylphenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Openeye Name: 1-(o-tolyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea CAS Name: 1-(2-methylphenyl)-3-[4-(1-pyrazolylmethyl)phenyl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Traditional Name: 1-(o-tolyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Formula: C18H18N4S MolecularWeight: 322.42732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C18H18N4S/c1-14-5-2-3-6-17(14)21-18(23)20-16-9-7-15(8-10-16)13-22-12-4-11-19-22/h2-12H,13H2,1H3,(H2,20,21,23)