N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methylpropyl)-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-isobutyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-methylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(2-methylpropyl)-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-isobutyl-3-keto-4H-1,4-benzothiazine-6-carboxamide Formula: C21H27N5O4S MolecularWeight: 445.53518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC(C)C)C(=O)C2=CC3=C(C=C2)SCC(=O)N3)N

InChI

InChI=1S/C21H27N5O4S/c1-4-5-8-25-18(22)17(19(28)24-21(25)30)26(10-12(2)3)20(29)13-6-7-15-14(9-13)23-16(27)11-31-15/h6-7,9,12H,4-5,8,10-11,22H2,1-3H3,(H,23,27)(H,24,28,30)