3-(2-oxidanylidene-1,3-benzothiazol-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(2-oxidanylidene-1,3-benzothiazol-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(2-keto-1,3-benzothiazol-3-yl)-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C4=CC=CC=C4SC3=O

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCN3C4=CC=CC=C4SC3=O

InChI

InChI=1S/C20H21N3O4S2/c24-19(11-14-23-17-5-1-2-6-18(17)28-20(23)25)21-15-7-9-16(10-8-15)29(26,27)22-12-3-4-13-22/h1-2,5-10H,3-4,11-14H2,(H,21,24)