N-[4-[4-[2-(4-chlorophenyl)ethyl]piperazin-1-yl]carbonylphenyl]-2-sulfanyl-butanamide

Systemtic Name: N-[4-[4-[2-(4-chlorophenyl)ethyl]piperazin-1-yl]carbonylphenyl]-2-sulfanyl-butanamide Openeye Name: N-[4-[4-[2-(4-chlorophenyl)ethyl]piperazine-1-carbonyl]phenyl]-2-sulfanyl-butanamide CAS Name: N-[4-[[4-[2-(4-chlorophenyl)ethyl]-1-piperazinyl]-oxomethyl]phenyl]-2-mercaptobutanamide IUPAC Name: N-[4-[4-[2-(4-chlorophenyl)ethyl]piperazine-1-carbonyl]phenyl]-2-sulfanylbutanamide Traditional Name: N-[4-[4-[2-(4-chlorophenyl)ethyl]piperazine-1-carbonyl]phenyl]-2-mercapto-butyramide Formula: C23H28ClN3O2S MolecularWeight: 446.00532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCC3=CC=C(C=C3)Cl)S

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)N2CCN(CC2)CCC3=CC=C(C=C3)Cl)S

InChI

InChI=1S/C23H28ClN3O2S/c1-2-21(30)22(28)25-20-9-5-18(6-10-20)23(29)27-15-13-26(14-16-27)12-11-17-3-7-19(24)8-4-17/h3-10,21,30H,2,11-16H2,1H3,(H,25,28)