4-[4-[5-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]benzamide

Systemtic Name: 4-[4-[5-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-3-oxidanylidene-1,4-benzothiazin-2-yl]benzamide Openeye Name: 4-[4-[5-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-3-oxo-1,4-benzothiazin-2-yl]benzamide CAS Name: 4-[4-[5-[2-(hydroxymethyl)-1-pyrrolidinyl]pentyl]-3-oxo-1,4-benzothiazin-2-yl]benzamide IUPAC Name: 4-[4-[5-[2-(hydroxymethyl)pyrrolidin-1-yl]pentyl]-3-oxo-1,4-benzothiazin-2-yl]benzamide Traditional Name: 4-[3-keto-4-[5-(2-methylolpyrrolidino)pentyl]-1,4-benzothiazin-2-yl]benzamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CCCCCN2C3=CC=CC=C3SC(C2=O)C4=CC=C(C=C4)C(=O)N)CO

Isomeric SMILES

C1CC(N(C1)CCCCCN2C3=CC=CC=C3SC(C2=O)C4=CC=C(C=C4)C(=O)N)CO

InChI

InChI=1S/C25H31N3O3S/c26-24(30)19-12-10-18(11-13-19)23-25(31)28(21-8-2-3-9-22(21)32-23)16-5-1-4-14-27-15-6-7-20(27)17-29/h2-3,8-13,20,23,29H,1,4-7,14-17H2,(H2,26,30)