N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidinosulfonyl-benzamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O4S2/c1-2-28-16-9-10-18-19(14-16)29-21(22-18)23-20(25)15-7-6-8-17(13-15)30(26,27)24-11-4-3-5-12-24/h6-10,13-14H,2-5,11-12H2,1H3,(H,22,23,25)