N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: N-[[2-(2-naphthyloxy)propanoylamino]carbamothioyl]-4-phenethyloxy-benzamide CAS Name: N-[[[2-(2-naphthalenyloxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]-4-phenethyloxybenzamide Traditional Name: N-[[2-(2-naphthoxy)propanoylamino]thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C29H27N3O4S MolecularWeight: 513.60738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)OCCC2=CC=CC=C2)OC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C(=O)NNC(=S)NC(=O)C1=CC=C(C=C1)OCCC2=CC=CC=C2)OC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H27N3O4S/c1-20(36-26-16-11-22-9-5-6-10-24(22)19-26)27(33)31-32-29(37)30-28(34)23-12-14-25(15-13-23)35-18-17-21-7-3-2-4-8-21/h2-16,19-20H,17-18H2,1H3,(H,31,33)(H2,30,32,34,37)