N-(phenylmethyl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanamide

Systemtic Name: N-(phenylmethyl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanamide Openeye Name: N-benzyl-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)acetamide CAS Name: N-(phenylmethyl)-2-[6-(1-pyrrolidinylsulfonyl)-2,3-dihydro-1,4-benzothiazin-4-yl]acetamide IUPAC Name: N-benzyl-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)acetamide Traditional Name: N-benzyl-2-(6-pyrrolidinosulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)acetamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCCN3CC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCCN3CC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C21H25N3O3S2/c25-21(22-15-17-6-2-1-3-7-17)16-23-12-13-28-20-9-8-18(14-19(20)23)29(26,27)24-10-4-5-11-24/h1-3,6-9,14H,4-5,10-13,15-16H2,(H,22,25)