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

Systemtic Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]propionamide Formula: C24H29N3O3S MolecularWeight: 439.57036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)CCN2C(=O)CSC3=CC=CC=C32)N4CCCC4

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)CCN2C(=O)CSC3=CC=CC=C32)N4CCCC4

InChI

InChI=1S/C24H29N3O3S/c1-30-21-10-4-2-8-18(21)20(26-13-6-7-14-26)16-25-23(28)12-15-27-19-9-3-5-11-22(19)31-17-24(27)29/h2-5,8-11,20H,6-7,12-17H2,1H3,(H,25,28)