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

Systemtic Name: 4-chloranyl-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-(6-methoxy-1,3-benzothiazol-2-yl)-3-pyrrolidinosulfonyl-benzamide Formula: C19H18ClN3O4S2 MolecularWeight: 451.94692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C19H18ClN3O4S2/c1-27-13-5-7-15-16(11-13)28-19(21-15)22-18(24)12-4-6-14(20)17(10-12)29(25,26)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,21,22,24)