1-[(3-nitrophenyl)amino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(3-nitrophenyl)amino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-nitroanilino)thiourea CAS Name: 1-(3-nitroanilino)-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-(3-nitroanilino)thiourea Traditional Name: 1-benzyl-3-(3-nitroanilino)thiourea Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NNC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NNC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O2S/c19-18(20)13-8-4-7-12(9-13)16-17-14(21)15-10-11-5-2-1-3-6-11/h1-9,16H,10H2,(H2,15,17,21)