4-[2-(4-chlorophenyl)-2-ethoxy-ethyl]sulfonyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazine-2-carboxamide hydrochloride

Systemtic Name: 4-[2-(4-chlorophenyl)-2-ethoxy-ethyl]sulfonyl-1-(4-pyridin-4-ylphenyl)carbonyl-piperazine-2-carboxamide hydrochloride Openeye Name: 4-[2-(4-chlorophenyl)-2-ethoxy-ethyl]sulfonyl-1-[4-(4-pyridyl)benzoyl]piperazine-2-carboxamide hydrochloride CAS Name: 4-[2-(4-chlorophenyl)-2-ethoxyethyl]sulfonyl-1-[oxo-(4-pyridin-4-ylphenyl)methyl]-2-piperazinecarboxamide hydrochloride IUPAC Name: 4-[2-(4-chlorophenyl)-2-ethoxyethyl]sulfonyl-1-(4-pyridin-4-ylbenzoyl)piperazine-2-carboxamide hydrochloride Traditional Name: 4-[2-(4-chlorophenyl)-2-ethoxy-ethyl]sulfonyl-1-[4-(4-pyridyl)benzoyl]piperazine-2-carboxamide hydrochloride Formula: C27H30Cl2N4O5S MolecularWeight: 593.5219

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CS(=O)(=O)N1CCN(C(C1)C(=O)N)C(=O)C2=CC=C(C=C2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

CCOC(CS(=O)(=O)N1CCN(C(C1)C(=O)N)C(=O)C2=CC=C(C=C2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C27H29ClN4O5S.ClH/c1-2-37-25(21-7-9-23(28)10-8-21)18-38(35,36)31-15-16-32(24(17-31)26(29)33)27(34)22-5-3-19(4-6-22)20-11-13-30-14-12-20;/h3-14,24-25H,2,15-18H2,1H3,(H2,29,33);1H