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

Systemtic Name: N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]-3,5-dinitro-benzamide Openeye Name: N-[[[2-(2-naphthyloxy)acetyl]amino]carbamothioyl]-3,5-dinitro-benzamide CAS Name: N-[[[2-(2-naphthalenyloxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3,5-dinitrobenzamide IUPAC Name: N-[[(2-naphthalen-2-yloxyacetyl)amino]carbamothioyl]-3,5-dinitrobenzamide Traditional Name: N-[[[2-(2-naphthoxy)acetyl]amino]thiocarbamoyl]-3,5-dinitro-benzamide Formula: C20H15N5O7S MolecularWeight: 469.4274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NNC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OCC(=O)NNC(=S)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H15N5O7S/c26-18(11-32-17-6-5-12-3-1-2-4-13(12)9-17)22-23-20(33)21-19(27)14-7-15(24(28)29)10-16(8-14)25(30)31/h1-10H,11H2,(H,22,26)(H2,21,23,27,33)