N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C21H23N3O5S2/c1-3-29-15-7-8-16-18(13-15)30-21(22-16)23-20(25)14-6-9-17(28-2)19(12-14)31(26,27)24-10-4-5-11-24/h6-9,12-13H,3-5,10-11H2,1-2H3,(H,22,23,25)