2-[2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanylethanoylamino]benzamide

Systemtic Name: 2-[2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanylethanoylamino]benzamide Openeye Name: 2-[[2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanylacetyl]amino]benzamide CAS Name: 2-[[2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 2-[[2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanylacetyl]amino]benzamide Traditional Name: 2-[[2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]acetyl]amino]benzamide Formula: C23H22N4O2S2 MolecularWeight: 450.57638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=CC=C3C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC(=CC=C2)SCC(=O)NC3=CC=CC=C3C(=O)N

InChI

InChI=1S/C23H22N4O2S2/c1-15-9-11-16(12-10-15)25-23(30)26-17-5-4-6-18(13-17)31-14-21(28)27-20-8-3-2-7-19(20)22(24)29/h2-13H,14H2,1H3,(H2,24,29)(H,27,28)(H2,25,26,30)