(3-chlorophenyl)methyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate

Systemtic Name: (3-chlorophenyl)methyl N'-[(4-nitrophenyl)carbonylamino]carbamimidothioate Openeye Name: N-[(E)-[amino-[(3-chlorophenyl)methylsulfanyl]methylene]amino]-4-nitro-benzamide CAS Name: N'-[[(4-nitrophenyl)-oxomethyl]amino]carbamimidothioic acid (3-chlorophenyl)methyl ester IUPAC Name: (3-chlorophenyl)methyl N'-[(4-nitrobenzoyl)amino]carbamimidothioate Traditional Name: N-[(E)-[amino-[(3-chlorobenzyl)thio]methylene]amino]-4-nitro-benzamide Formula: C15H13ClN4O3S MolecularWeight: 364.80672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CSC(=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CS/C(=N/NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])/N

InChI

InChI=1S/C15H13ClN4O3S/c16-12-3-1-2-10(8-12)9-24-15(17)19-18-14(21)11-4-6-13(7-5-11)20(22)23/h1-8H,9H2,(H2,17,19)(H,18,21)