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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-thiophen-2-yl]-3,4-dimethoxy-benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-2-thienyl]-3,4-dimethoxy-benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methyl-2-thiophenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-(1,3-benzothiazol-2-yl)-4-methylthiophen-2-yl]-3,4-dimethoxybenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-4-methyl-5-piperonyl-2-thienyl]-3,4-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=CC(=C(C=C4)OC)OC)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

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

InChI

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