(4E)-4-(carbamothioylhydrazinylidene)-N-(2,4-dinitrophenyl)chromene-2-carboxamide

Systemtic Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(2,4-dinitrophenyl)chromene-2-carboxamide Openeye Name: (4E)-4-(carbamothioylhydrazono)-N-(2,4-dinitrophenyl)chromene-2-carboxamide CAS Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(2,4-dinitrophenyl)-1-benzopyran-2-carboxamide IUPAC Name: (4E)-4-(carbamothioylhydrazinylidene)-N-(2,4-dinitrophenyl)chromene-2-carboxamide Traditional Name: (4E)-N-(2,4-dinitrophenyl)-4-(thiocarbamoylhydrazono)chromene-2-carboxamide Formula: C17H12N6O6S MolecularWeight: 428.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC(=S)N)C=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)/C(=N/NC(=S)N)/C=C(O2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H12N6O6S/c18-17(30)21-20-12-8-15(29-14-4-2-1-3-10(12)14)16(24)19-11-6-5-9(22(25)26)7-13(11)23(27)28/h1-8H,(H,19,24)(H3,18,21,30)/b20-12+