N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[2-(4-methoxyphenyl)ethanoylamino]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[[2-(4-methoxyphenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[[2-(4-methoxyphenyl)acetyl]amino]thiocarbamoyl]-3-propoxy-benzamide Formula: C20H23N3O4S MolecularWeight: 401.47932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H23N3O4S/c1-3-11-27-17-6-4-5-15(13-17)19(25)21-20(28)23-22-18(24)12-14-7-9-16(26-2)10-8-14/h4-10,13H,3,11-12H2,1-2H3,(H,22,24)(H2,21,23,25,28)