5-[(E)-3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]-2-methoxy-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 5-[(E)-3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxidanylidene-prop-1-enyl]-2-methoxy-N-propan-2-yl-benzenesulfonamide Openeye Name: 5-[(E)-3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxo-prop-1-enyl]-N-isopropyl-2-methoxy-benzenesulfonamide CAS Name: 5-[(E)-3-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-oxoprop-1-enyl]-2-methoxy-N-propan-2-ylbenzenesulfonamide IUPAC Name: 5-[(E)-3-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-oxoprop-1-enyl]-2-methoxy-N-propan-2-ylbenzenesulfonamide Traditional Name: 5-[(E)-3-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-keto-prop-1-enyl]-N-isopropyl-2-methoxy-benzenesulfonamide Formula: C24H27N3O4S2 MolecularWeight: 485.61888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=C(C=CC(=C1)C=CC(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

CC(C)NS(=O)(=O)C1=C(C=CC(=C1)/C=C/C(=O)N2CCCC2C3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C24H27N3O4S2/c1-16(2)26-33(29,30)22-15-17(10-12-20(22)31-3)11-13-23(28)27-14-6-8-19(27)24-25-18-7-4-5-9-21(18)32-24/h4-5,7,9-13,15-16,19,26H,6,8,14H2,1-3H3/b13-11+