ethyl (5Z)-5-[(2-carbamothioylhydrazinyl)methylidene]-6-chloranyl-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: ethyl (5Z)-5-[(2-carbamothioylhydrazinyl)methylidene]-6-chloranyl-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: ethyl (5Z)-5-[(2-carbamothioylhydrazino)methylene]-6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: (5Z)-5-[(carbamothioylhydrazo)methylidene]-6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-5-[(2-carbamothioylhydrazinyl)methylidene]-6-chloro-2-methyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: (5Z)-6-chloro-2-methyl-4-(3-nitrophenyl)-5-[(N'-thiocarbamoylhydrazino)methylene]-4H-pyridine-3-carboxylic acid ethyl ester Formula: C17H18ClN5O4S MolecularWeight: 423.87392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=CNNC(=S)N)C1C2=CC(=CC=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(/C(=C\NNC(=S)N)/C1C2=CC(=CC=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C17H18ClN5O4S/c1-3-27-16(24)13-9(2)21-15(18)12(8-20-22-17(19)28)14(13)10-5-4-6-11(7-10)23(25)26/h4-8,14,20H,3H2,1-2H3,(H3,19,22,28)/b12-8-