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

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

Systemtic Name:N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-(2-methoxyethyl)-2-methyl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide
Openeye Name:N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-(2-methoxyethyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CAS Name:N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-(2-methoxyethyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide
IUPAC Name:N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-(2-methoxyethyl)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carboxamide
Traditional Name:N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-keto-N-(2-methoxyethyl)-2-methyl-4H-1,4-benzothiazine-6-carboxamide
Formula: C21H27N5O5S
MolecularWeight: 461.53458
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C)N


Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC3=C(C=C2)SC(C(=O)N3)C)N


InChI

InChI=1S/C21H27N5O5S/c1-4-5-8-26-17(22)16(19(28)24-21(26)30)25(9-10-31-3)20(29)13-6-7-15-14(11-13)23-18(27)12(2)32-15/h6-7,11-12H,4-5,8-10,22H2,1-3H3,(H,23,27)(H,24,28,30)


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