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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-methoxy-3-pyrrolidinosulfonyl-benzamide Formula: C25H23N3O4S2 MolecularWeight: 493.59782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)S(=O)(=O)N5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H23N3O4S2/c1-32-21-13-12-17(16-23(21)34(30,31)28-14-6-7-15-28)24(29)26-19-9-3-2-8-18(19)25-27-20-10-4-5-11-22(20)33-25/h2-5,8-13,16H,6-7,14-15H2,1H3,(H,26,29)