5-azanyl-N-butyl-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-nonanamide

Systemtic Name: 5-azanyl-N-butyl-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-4-oxidanyl-9-oxidanylidene-nonanamide Openeye Name: 5-amino-N-butyl-4-hydroxy-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-9-oxo-nonanamide CAS Name: 5-amino-N-butyl-4-hydroxy-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-9-oxononanamide IUPAC Name: 5-amino-N-butyl-4-hydroxy-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-9-oxononanamide Traditional Name: 5-amino-N-butyl-4-hydroxy-9-keto-9-[2-(methoxymethyl)-2,3-dihydro-1,4-benzothiazin-4-yl]-2,7,7-trimethyl-pelargonamide Formula: C26H43N3O4S MolecularWeight: 493.70232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(SC2=CC=CC=C21)COC)N)O

Isomeric SMILES

CCCCNC(=O)C(C)CC(C(CC(C)(C)CC(=O)N1CC(SC2=CC=CC=C21)COC)N)O

InChI

InChI=1S/C26H43N3O4S/c1-6-7-12-28-25(32)18(2)13-22(30)20(27)14-26(3,4)15-24(31)29-16-19(17-33-5)34-23-11-9-8-10-21(23)29/h8-11,18-20,22,30H,6-7,12-17,27H2,1-5H3,(H,28,32)