N-[(2-naphthalen-1-yloxyethanoylamino)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[(2-naphthalen-1-yloxyethanoylamino)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[[[2-(1-naphthyloxy)acetyl]amino]carbamothioyl]-3-nitro-benzamide CAS Name: N-[[[2-(1-naphthalenyloxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[[(2-naphthalen-1-yloxyacetyl)amino]carbamothioyl]-3-nitrobenzamide Traditional Name: N-[[[2-(1-naphthoxy)acetyl]amino]thiocarbamoyl]-3-nitro-benzamide Formula: C20H16N4O5S MolecularWeight: 424.42984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2OCC(=O)NNC(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O5S/c25-18(12-29-17-10-4-6-13-5-1-2-9-16(13)17)22-23-20(30)21-19(26)14-7-3-8-15(11-14)24(27)28/h1-11H,12H2,(H,22,25)(H2,21,23,26,30)