N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-(3-oxo-1,4-benzothiazin-4-yl)acetamide Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]acetamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)CN2C(=O)CSC3=CC=CC=C32)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)CN2C(=O)CSC3=CC=CC=C32)N4CCCC4

InChI

InChI=1S/C23H27N3O3S/c1-29-18-8-6-7-17(13-18)20(25-11-4-5-12-25)14-24-22(27)15-26-19-9-2-3-10-21(19)30-16-23(26)28/h2-3,6-10,13,20H,4-5,11-12,14-16H2,1H3,(H,24,27)