N-[2-chloranyl-4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-chloranyl-4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-chloro-4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-chloro-4-[[(1-ethyl-2-pyrrolidinyl)methylamino]-oxomethyl]-5-methoxyphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-chloro-4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-5-methoxyphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-chloro-4-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-5-methoxy-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C20H26ClN3O4S MolecularWeight: 439.95614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)NC(=O)C3=CSCCO3)Cl

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)NC(=O)C3=CSCCO3)Cl

InChI

InChI=1S/C20H26ClN3O4S/c1-3-24-6-4-5-13(24)11-22-19(25)14-9-15(21)16(10-17(14)27-2)23-20(26)18-12-29-8-7-28-18/h9-10,12-13H,3-8,11H2,1-2H3,(H,22,25)(H,23,26)