N-(4-butylphenyl)-6,7-dimethoxy-4-methyl-2,2-bis(oxidanylidene)-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide

Systemtic Name: N-(4-butylphenyl)-6,7-dimethoxy-4-methyl-2,2-bis(oxidanylidene)-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide Openeye Name: 1-allyl-N-(4-butylphenyl)-6,7-dimethoxy-4-methyl-2,2-dioxo-2$l^{6},1-benzothiazine-3-carboxamide CAS Name: N-(4-butylphenyl)-6,7-dimethoxy-4-methyl-2,2-dioxo-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide IUPAC Name: N-(4-butylphenyl)-6,7-dimethoxy-4-methyl-2,2-dioxo-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide Traditional Name: 1-allyl-N-(4-butylphenyl)-2,2-diketo-6,7-dimethoxy-4-methyl-2$l^{6},1-benzothiazine-3-carboxamide Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC(=C(C=C3N(S2(=O)=O)CC=C)OC)OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC(=C(C=C3N(S2(=O)=O)CC=C)OC)OC)C

InChI

InChI=1S/C25H30N2O5S/c1-6-8-9-18-10-12-19(13-11-18)26-25(28)24-17(3)20-15-22(31-4)23(32-5)16-21(20)27(14-7-2)33(24,29)30/h7,10-13,15-16H,2,6,8-9,14H2,1,3-5H3,(H,26,28)