N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-2-(4-nitrophenoxy)ethanamide

Systemtic Name: N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-2-(4-nitrophenoxy)ethanamide Openeye Name: N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]-2-(4-nitrophenoxy)acetamide CAS Name: N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-(4-nitrophenoxy)acetamide IUPAC Name: N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]-2-(4-nitrophenoxy)acetamide Traditional Name: N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]-2-(4-nitrophenoxy)acetamide Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O5S/c26-19(12-15-6-3-5-14-4-1-2-7-18(14)15)23-24-21(31)22-20(27)13-30-17-10-8-16(9-11-17)25(28)29/h1-11H,12-13H2,(H,23,26)(H2,22,24,27,31)