1-(4-chlorophenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea CAS Name: 1-(4-chlorophenyl)-3-[1-(1-naphthalenylmethyl)-4-pyrazolyl]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[1-(1-naphthylmethyl)pyrazol-4-yl]thiourea Formula: C21H17ClN4S MolecularWeight: 392.90448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C=N3)NC(=S)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN4S/c22-17-8-10-18(11-9-17)24-21(27)25-19-12-23-26(14-19)13-16-6-3-5-15-4-1-2-7-20(15)16/h1-12,14H,13H2,(H2,24,25,27)