N-(4-ethoxyphenyl)-4-(3-methylsulfanylpropylcarbamothioylamino)benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-(3-methylsulfanylpropylcarbamothioylamino)benzamide Openeye Name: N-(4-ethoxyphenyl)-4-(3-methylsulfanylpropylcarbamothioylamino)benzamide CAS Name: N-(4-ethoxyphenyl)-4-[[[3-(methylthio)propylamino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(4-ethoxyphenyl)-4-(3-methylsulfanylpropylcarbamothioylamino)benzamide Traditional Name: 4-[3-(methylthio)propylthiocarbamoylamino]-N-p-phenetyl-benzamide Formula: C20H25N3O2S2 MolecularWeight: 403.5614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=S)NCCCSC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=S)NCCCSC

InChI

InChI=1S/C20H25N3O2S2/c1-3-25-18-11-9-16(10-12-18)22-19(24)15-5-7-17(8-6-15)23-20(26)21-13-4-14-27-2/h5-12H,3-4,13-14H2,1-2H3,(H,22,24)(H2,21,23,26)