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

Systemtic Name: N-[4-chloranyl-3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide Openeye Name: N-[4-chloro-3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide CAS Name: N-[4-chloro-3-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: N-[4-chloro-3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide Traditional Name: N-[4-chloro-3-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]butyramide Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H21Cl2N3O2S/c1-2-5-18(26)23-14-9-10-16(22)17(12-14)24-20(28)25-19(27)11-8-13-6-3-4-7-15(13)21/h3-4,6-7,9-10,12H,2,5,8,11H2,1H3,(H,23,26)(H2,24,25,27,28)