N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C25H27N3O3S/c1-2-3-6-16-31-21-14-12-19(13-15-21)24(30)26-25(32)28-27-23(29)17-20-10-7-9-18-8-4-5-11-22(18)20/h4-5,7-15H,2-3,6,16-17H2,1H3,(H,27,29)(H2,26,28,30,32)