N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]-4-piperidinosulfonyl-benzamide Formula: C22H25N3O3S3 MolecularWeight: 475.6472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CSCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O3S3/c1-29-16-15-25-19-7-3-4-8-20(19)30-22(25)23-21(26)17-9-11-18(12-10-17)31(27,28)24-13-5-2-6-14-24/h3-4,7-12H,2,5-6,13-16H2,1H3