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

Systemtic Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3-methoxy-4-methyl-benzamide Openeye Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3-methoxy-4-methyl-benzamide CAS Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3-methoxy-4-methylbenzamide IUPAC Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3-methoxy-4-methylbenzamide Traditional Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-3-methoxy-4-methyl-benzamide Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)OC

InChI

InChI=1S/C21H22N2O5S/c1-12-4-5-13(10-16(12)26-3)20(24)23-21-22-18-15(25-2)7-6-14(19(18)29-21)17-11-27-8-9-28-17/h4-7,10,17H,8-9,11H2,1-3H3,(H,22,23,24)