1-(4-nitrophenyl)-3-(phenylmethyl)thiourea

Systemtic Name: 1-(4-nitrophenyl)-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(4-nitrophenyl)thiourea CAS Name: 1-(4-nitrophenyl)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(4-nitrophenyl)thiourea Traditional Name: 1-benzyl-3-(4-nitrophenyl)thiourea Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O2S/c18-17(19)13-8-6-12(7-9-13)16-14(20)15-10-11-4-2-1-3-5-11/h1-9H,10H2,(H2,15,16,20)