N-(2,3-dihydroindol-1-ylcarbothioyl)-3,5-dinitro-benzamide

Systemtic Name: N-(2,3-dihydroindol-1-ylcarbothioyl)-3,5-dinitro-benzamide Openeye Name: N-(indoline-1-carbothioyl)-3,5-dinitro-benzamide CAS Name: N-[2,3-dihydroindol-1-yl(sulfanylidene)methyl]-3,5-dinitrobenzamide IUPAC Name: N-(2,3-dihydroindole-1-carbothioyl)-3,5-dinitrobenzamide Traditional Name: N-(indoline-1-carbothioyl)-3,5-dinitro-benzamide Formula: C16H12N4O5S MolecularWeight: 372.35528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)C(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O5S/c21-15(11-7-12(19(22)23)9-13(8-11)20(24)25)17-16(26)18-6-5-10-3-1-2-4-14(10)18/h1-4,7-9H,5-6H2,(H,17,21,26)