1-(4-nitrophenyl)-3-(phenylcarbamothioylamino)urea

Systemtic Name: 1-(4-nitrophenyl)-3-(phenylcarbamothioylamino)urea Openeye Name: 1-(4-nitrophenyl)-3-(phenylcarbamothioylamino)urea CAS Name: 1-[[anilino(sulfanylidene)methyl]amino]-3-(4-nitrophenyl)urea IUPAC Name: 1-(4-nitrophenyl)-3-(phenylcarbamothioylamino)urea Traditional Name: 1-(4-nitrophenyl)-3-(phenylthiocarbamoylamino)urea Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N5O3S/c20-13(15-11-6-8-12(9-7-11)19(21)22)17-18-14(23)16-10-4-2-1-3-5-10/h1-9H,(H2,15,17,20)(H2,16,18,23)