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

Systemtic Name: N-(4-butylphenyl)-2,2-bis(oxidanylidene)-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide Openeye Name: 1-allyl-N-(4-butylphenyl)-2,2-dioxo-4-phenyl-2$l^{6},1-benzothiazine-3-carboxamide CAS Name: N-(4-butylphenyl)-2,2-dioxo-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide IUPAC Name: N-(4-butylphenyl)-2,2-dioxo-4-phenyl-1-prop-2-enyl-2$l^{6},1-benzothiazine-3-carboxamide Traditional Name: 1-allyl-N-(4-butylphenyl)-2,2-diketo-4-phenyl-2$l^{6},1-benzothiazine-3-carboxamide Formula: C28H28N2O3S MolecularWeight: 472.59852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3N(S2(=O)=O)CC=C)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3N(S2(=O)=O)CC=C)C4=CC=CC=C4

InChI

InChI=1S/C28H28N2O3S/c1-3-5-11-21-16-18-23(19-17-21)29-28(31)27-26(22-12-7-6-8-13-22)24-14-9-10-15-25(24)30(20-4-2)34(27,32)33/h4,6-10,12-19H,2-3,5,11,20H2,1H3,(H,29,31)