prop-2-enyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate

Systemtic Name: prop-2-enyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate Openeye Name: N-[(E)-[allylsulfanyl(amino)methylene]amino]-4-nitro-benzamide CAS Name: N'-[[(4-nitrophenyl)-oxomethyl]amino]carbamimidothioic acid prop-2-enyl ester IUPAC Name: prop-2-enyl N'-[(4-nitrobenzoyl)amino]carbamimidothioate Traditional Name: N-[(E)-[(allylthio)-amino-methylene]amino]-4-nitro-benzamide Formula: C11H12N4O3S MolecularWeight: 280.30298

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC(=NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])N

Isomeric SMILES

C=CCS/C(=N/NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])/N

InChI

InChI=1S/C11H12N4O3S/c1-2-7-19-11(12)14-13-10(16)8-3-5-9(6-4-8)15(17)18/h2-6H,1,7H2,(H2,12,14)(H,13,16)