N-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propyl]-4-piperidinosulfonyl-benzamide Formula: C22H26N4O5S2 MolecularWeight: 490.59564

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCNC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCNC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C22H26N4O5S2/c27-22(17-9-11-18(12-10-17)33(30,31)26-15-4-1-5-16-26)24-14-6-13-23-21-19-7-2-3-8-20(19)32(28,29)25-21/h2-3,7-12H,1,4-6,13-16H2,(H,23,25)(H,24,27)