N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]-2,6-dimethoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]-2,6-dimethoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]-2,6-dimethoxybenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4-methyl-5-piperonyl-2-thienyl]-2,6-dimethoxy-benzamide Formula: C29H24N2O5S2 MolecularWeight: 544.64126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C=CC=C4OC)OC)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=C(SC(=C1C2=NC3=CC=CC=C3S2)NC(=O)C4=C(C=CC=C4OC)OC)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C29H24N2O5S2/c1-16-24(14-17-11-12-19-22(13-17)36-15-35-19)38-29(25(16)28-30-18-7-4-5-10-23(18)37-28)31-27(32)26-20(33-2)8-6-9-21(26)34-3/h4-13H,14-15H2,1-3H3,(H,31,32)