3-(3-oxidanylidene-1,4-benzothiazin-4-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide

Systemtic Name: 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)propanamide Openeye Name: 3-(3-oxo-1,4-benzothiazin-4-yl)-N-[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]propanamide CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)-N-[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]propanamide IUPAC Name: 3-(3-oxo-1,4-benzothiazin-4-yl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)propanamide Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)-N-[2-pyrrolidino-2-(2-thienyl)ethyl]propionamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCN2C(=O)CSC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCN2C(=O)CSC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C21H25N3O2S2/c25-20(9-12-24-16-6-1-2-7-18(16)28-15-21(24)26)22-14-17(19-8-5-13-27-19)23-10-3-4-11-23/h1-2,5-8,13,17H,3-4,9-12,14-15H2,(H,22,25)