2-chloranyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-5-piperidinosulfonyl-benzamide Formula: C21H22ClN3O3S2 MolecularWeight: 464.00068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C21H22ClN3O3S2/c22-18-9-8-14(30(27,28)25-10-4-1-5-11-25)12-16(18)20(26)24-21-17(13-23)15-6-2-3-7-19(15)29-21/h8-9,12H,1-7,10-11H2,(H,24,26)