N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-3,5-dinitro-benzamide

Systemtic Name: N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-3,5-dinitro-benzamide Openeye Name: N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]-3,5-dinitro-benzamide CAS Name: N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3,5-dinitrobenzamide IUPAC Name: N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]-3,5-dinitrobenzamide Traditional Name: N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]-3,5-dinitro-benzamide Formula: C20H15N5O6S MolecularWeight: 453.428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O6S/c26-18(10-13-6-3-5-12-4-1-2-7-17(12)13)22-23-20(32)21-19(27)14-8-15(24(28)29)11-16(9-14)25(30)31/h1-9,11H,10H2,(H,22,26)(H2,21,23,27,32)