N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)phenyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C24H20ClN3O3S2 MolecularWeight: 498.0169

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H20ClN3O3S2/c25-20-12-11-18(33(30,31)28-13-3-4-14-28)15-19(20)23(29)26-17-9-7-16(8-10-17)24-27-21-5-1-2-6-22(21)32-24/h1-2,5-12,15H,3-4,13-14H2,(H,26,29)