2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-2-piperidin-4-yl-ethanenitrile

Systemtic Name: 2-[4-(6-chloranylnaphthalen-2-yl)sulfonyl-2-oxidanylidene-piperazin-1-yl]-2-piperidin-4-yl-ethanenitrile Openeye Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-oxo-piperazin-1-yl]-2-(4-piperidyl)acetonitrile CAS Name: 2-[4-[(6-chloro-2-naphthalenyl)sulfonyl]-2-oxo-1-piperazinyl]-2-(4-piperidinyl)acetonitrile IUPAC Name: 2-[4-(6-chloronaphthalen-2-yl)sulfonyl-2-oxopiperazin-1-yl]-2-piperidin-4-ylacetonitrile Traditional Name: 2-[4-[(6-chloro-2-naphthyl)sulfonyl]-2-keto-piperazino]-2-(4-piperidyl)acetonitrile Formula: C21H23ClN4O3S MolecularWeight: 446.95032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(C#N)N2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

C1CNCCC1C(C#N)N2CCN(CC2=O)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN4O3S/c22-18-3-1-17-12-19(4-2-16(17)11-18)30(28,29)25-9-10-26(21(27)14-25)20(13-23)15-5-7-24-8-6-15/h1-4,11-12,15,20,24H,5-10,14H2