N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxy-benzamide CAS Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxybenzamide IUPAC Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3,4-dimethoxy-benzamide Formula: C21H22N2O6S MolecularWeight: 430.47418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)OC

InChI

InChI=1S/C21H22N2O6S/c1-25-14-6-4-12(10-16(14)27-3)20(24)23-21-22-18-15(26-2)7-5-13(19(18)30-21)17-11-28-8-9-29-17/h4-7,10,17H,8-9,11H2,1-3H3,(H,22,23,24)