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

Systemtic Name: 2-[2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanylbutanoylamino]benzamide Openeye Name: 2-[2-[3-(p-tolylcarbamothioylamino)phenyl]sulfanylbutanoylamino]benzamide CAS Name: 2-[[2-[[3-[[(4-methylanilino)-sulfanylidenemethyl]amino]phenyl]thio]-1-oxobutyl]amino]benzamide IUPAC Name: 2-[2-[3-[(4-methylphenyl)carbamothioylamino]phenyl]sulfanylbutanoylamino]benzamide Traditional Name: 2-[2-[[3-(p-tolylthiocarbamoylamino)phenyl]thio]butanoylamino]benzamide Formula: C25H26N4O2S2 MolecularWeight: 478.62954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)N)SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)N)SC2=CC=CC(=C2)NC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C25H26N4O2S2/c1-3-22(24(31)29-21-10-5-4-9-20(21)23(26)30)33-19-8-6-7-18(15-19)28-25(32)27-17-13-11-16(2)12-14-17/h4-15,22H,3H2,1-2H3,(H2,26,30)(H,29,31)(H2,27,28,32)