4-[5-azanyl-8-(butylcarbamoyl)-3,3,9-trimethyl-6-oxidanyl-decanoyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide

Systemtic Name: 4-[5-azanyl-8-(butylcarbamoyl)-3,3,9-trimethyl-6-oxidanyl-decanoyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide Openeye Name: 4-[5-amino-8-(butylcarbamoyl)-6-hydroxy-3,3,9-trimethyl-decanoyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide CAS Name: 4-[5-amino-8-[butylamino(oxo)methyl]-6-hydroxy-3,3,9-trimethyl-1-oxodecyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide IUPAC Name: 4-[5-amino-8-(butylcarbamoyl)-6-hydroxy-3,3,9-trimethyldecanoyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide Traditional Name: 4-[5-amino-8-(butylcarbamoyl)-6-hydroxy-3,3,9-trimethyl-decanoyl]-2,3-dihydro-1,4-benzothiazine-2-carboxamide Formula: C27H44N4O4S MolecularWeight: 520.72766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H44N4O4S/c1-6-7-12-30-26(35)18(17(2)3)13-21(32)19(28)14-27(4,5)15-24(33)31-16-23(25(29)34)36-22-11-9-8-10-20(22)31/h8-11,17-19,21,23,32H,6-7,12-16,28H2,1-5H3,(H2,29,34)(H,30,35)