(4E)-4-[1,1-bis(oxidanylidene)-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene]-2-(3-methylbutyl)-6-thiophen-2-yl-pyridazine-3,5-dione

Systemtic Name: (4E)-4-[1,1-bis(oxidanylidene)-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene]-2-(3-methylbutyl)-6-thiophen-2-yl-pyridazine-3,5-dione Openeye Name: (4E)-4-(1,1-dioxo-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene)-2-isopentyl-6-(2-thienyl)pyridazine-3,5-dione CAS Name: (4E)-4-(1,1-dioxo-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene)-2-(3-methylbutyl)-6-thiophen-2-ylpyridazine-3,5-dione IUPAC Name: (4E)-4-(1,1-dioxo-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene)-2-(3-methylbutyl)-6-thiophen-2-ylpyridazine-3,5-dione Traditional Name: (4E)-4-(1,1-diketo-4H-pyrido[4,3-e][1,2,4]thiadiazin-3-ylidene)-2-isoamyl-6-(2-thienyl)pyridazine-3,5-quinone Formula: C19H19N5O4S2 MolecularWeight: 445.51526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C(=C2NC3=C(C=NC=C3)S(=O)(=O)N2)C(=O)C(=N1)C4=CC=CS4

Isomeric SMILES

CC(C)CCN1C(=O)/C(=C/2\NC3=C(C=NC=C3)S(=O)(=O)N2)/C(=O)C(=N1)C4=CC=CS4

InChI

InChI=1S/C19H19N5O4S2/c1-11(2)6-8-24-19(26)15(17(25)16(22-24)13-4-3-9-29-13)18-21-12-5-7-20-10-14(12)30(27,28)23-18/h3-5,7,9-11,21,23H,6,8H2,1-2H3/b18-15+