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

Systemtic Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide Openeye Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide CAS Name: N-[4-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]butanamide IUPAC Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]butanamide Traditional Name: N-[4-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]butyramide Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O2S/c1-2-5-18(25)22-15-9-11-16(12-10-15)23-20(27)24-19(26)13-8-14-6-3-4-7-17(14)21/h3-4,6-7,9-12H,2,5,8,13H2,1H3,(H,22,25)(H2,23,24,26,27)