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

Systemtic Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2,4-dimethyl-benzamide Openeye Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2,4-dimethyl-benzamide CAS Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2,4-dimethylbenzamide IUPAC Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2,4-dimethylbenzamide Traditional Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2,4-dimethyl-benzamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4S/c1-12-4-5-14(13(2)10-12)20(24)23-21-22-18-16(25-3)7-6-15(19(18)28-21)17-11-26-8-9-27-17/h4-7,10,17H,8-9,11H2,1-3H3,(H,22,23,24)