N-[2-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-[oxo-[2-(1-pyrrolidinyl)ethylamino]methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-(2-pyrrolidinoethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=CC=CC=C2NC(=O)C3=CSCCO3

InChI

InChI=1S/C18H23N3O3S/c22-17(19-7-10-21-8-3-4-9-21)14-5-1-2-6-15(14)20-18(23)16-13-25-12-11-24-16/h1-2,5-6,13H,3-4,7-12H2,(H,19,22)(H,20,23)