4-[3-[1-(butylamino)-2-cyclopropyl-1-oxidanylidene-propan-2-yl]hexanoyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide

Systemtic Name: 4-[3-[1-(butylamino)-2-cyclopropyl-1-oxidanylidene-propan-2-yl]hexanoyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide Openeye Name: 4-[3-[2-(butylamino)-1-cyclopropyl-1-methyl-2-oxo-ethyl]hexanoyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide CAS Name: 4-[3-[1-(butylamino)-2-cyclopropyl-1-oxopropan-2-yl]-1-oxohexyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide IUPAC Name: 4-[3-[1-(butylamino)-2-cyclopropyl-1-oxopropan-2-yl]hexanoyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide Traditional Name: 4-[3-[2-(butylamino)-1-cyclopropyl-2-keto-1-methyl-ethyl]hexanoyl]-N-methyl-2,3-dihydro-1,4-benzothiazine-2-carboxamide Formula: C26H39N3O3S MolecularWeight: 473.67116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)(C1CC1)C(CCC)CC(=O)N2CC(SC3=CC=CC=C32)C(=O)NC

Isomeric SMILES

CCCCNC(=O)C(C)(C1CC1)C(CCC)CC(=O)N2CC(SC3=CC=CC=C32)C(=O)NC

InChI

InChI=1S/C26H39N3O3S/c1-5-7-15-28-25(32)26(3,18-13-14-18)19(10-6-2)16-23(30)29-17-22(24(31)27-4)33-21-12-9-8-11-20(21)29/h8-9,11-12,18-19,22H,5-7,10,13-17H2,1-4H3,(H,27,31)(H,28,32)