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

Systemtic Name: 1-(4-nitrophenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Openeye Name: 1-(4-nitrophenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea CAS Name: 1-(4-nitrophenyl)-3-[4-(1-pyrazolylmethyl)phenyl]thiourea IUPAC Name: 1-(4-nitrophenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Traditional Name: 1-(4-nitrophenyl)-3-[4-(pyrazol-1-ylmethyl)phenyl]thiourea Formula: C17H15N5O2S MolecularWeight: 353.3983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CN(N=C1)CC2=CC=C(C=C2)NC(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O2S/c23-22(24)16-8-6-15(7-9-16)20-17(25)19-14-4-2-13(3-5-14)12-21-11-1-10-18-21/h1-11H,12H2,(H2,19,20,25)