N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanyl-butanamide CAS Name: 2-[[3-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(4-chloro-2-methoxy-5-methylphenyl)butanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[3-(phenylcarbamothioylamino)phenyl]sulfanylbutanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[3-(phenylthiocarbamoylamino)phenyl]thio]butyramide Formula: C25H26ClN3O2S2 MolecularWeight: 500.07584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C(=C1)C)Cl)OC)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C(=C1)C)Cl)OC)SC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C25H26ClN3O2S2/c1-4-23(24(30)29-21-13-16(2)20(26)15-22(21)31-3)33-19-12-8-11-18(14-19)28-25(32)27-17-9-6-5-7-10-17/h5-15,23H,4H2,1-3H3,(H,29,30)(H2,27,28,32)