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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=C(C=C2)CN3C=CC=N3

InChI

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