1-(3-nitrophenyl)-3-[1-(phenylmethyl)pyrazol-3-yl]thiourea

Systemtic Name: 1-(3-nitrophenyl)-3-[1-(phenylmethyl)pyrazol-3-yl]thiourea Openeye Name: 1-(1-benzylpyrazol-3-yl)-3-(3-nitrophenyl)thiourea CAS Name: 1-(3-nitrophenyl)-3-[1-(phenylmethyl)-3-pyrazolyl]thiourea IUPAC Name: 1-(1-benzylpyrazol-3-yl)-3-(3-nitrophenyl)thiourea Traditional Name: 1-(1-benzylpyrazol-3-yl)-3-(3-nitrophenyl)thiourea Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC(=N2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC(=N2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

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