N-[3-[2-(4-chlorophenyl)sulfanylethanoylcarbamothioylamino]phenyl]butanamide

Systemtic Name: N-[3-[2-(4-chlorophenyl)sulfanylethanoylcarbamothioylamino]phenyl]butanamide Openeye Name: N-[3-[[2-(4-chlorophenyl)sulfanylacetyl]carbamothioylamino]phenyl]butanamide CAS Name: N-[3-[[[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: N-[3-[[2-(4-chlorophenyl)sulfanylacetyl]carbamothioylamino]phenyl]butanamide Traditional Name: N-[3-[[2-[(4-chlorophenyl)thio]acetyl]thiocarbamoylamino]phenyl]butyramide Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CSC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClN3O2S2/c1-2-4-17(24)21-14-5-3-6-15(11-14)22-19(26)23-18(25)12-27-16-9-7-13(20)8-10-16/h3,5-11H,2,4,12H2,1H3,(H,21,24)(H2,22,23,25,26)