2-[1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: 2-[1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-piperazin-2-yl]-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: 2-[1-(4-chlorophenyl)sulfonyl-3-oxo-piperazin-2-yl]-N-(3-pyridylmethyl)acetamide CAS Name: 2-[1-(4-chlorophenyl)sulfonyl-3-oxo-2-piperazinyl]-N-(3-pyridinylmethyl)acetamide IUPAC Name: 2-[1-(4-chlorophenyl)sulfonyl-3-oxopiperazin-2-yl]-N-(pyridin-3-ylmethyl)acetamide Traditional Name: 2-[1-(4-chlorophenyl)sulfonyl-3-keto-piperazin-2-yl]-N-(3-pyridylmethyl)acetamide Formula: C18H19ClN4O4S MolecularWeight: 422.88586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(C(C(=O)N1)CC(=O)NCC2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4O4S/c19-14-3-5-15(6-4-14)28(26,27)23-9-8-21-18(25)16(23)10-17(24)22-12-13-2-1-7-20-11-13/h1-7,11,16H,8-10,12H2,(H,21,25)(H,22,24)