3-nitro-N-[(6-oxidanylnaphthalen-1-yl)carbamothioyl]benzamide

Systemtic Name: 3-nitro-N-[(6-oxidanylnaphthalen-1-yl)carbamothioyl]benzamide Openeye Name: N-[(6-hydroxy-1-naphthyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[[(6-hydroxy-1-naphthalenyl)amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(6-hydroxynaphthalen-1-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(6-hydroxy-1-naphthyl)thiocarbamoyl]-3-nitro-benzamide Formula: C18H13N3O4S MolecularWeight: 367.37852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC(=C3)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=S)NC2=CC=CC3=C2C=CC(=C3)O

InChI

InChI=1S/C18H13N3O4S/c22-14-7-8-15-11(10-14)3-2-6-16(15)19-18(26)20-17(23)12-4-1-5-13(9-12)21(24)25/h1-10,22H,(H2,19,20,23,26)