5-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propoxy]-2-methyl-1,3-benzothiazole

Systemtic Name: 5-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propoxy]-2-methyl-1,3-benzothiazole Openeye Name: 5-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperidyl]propoxy]-2-methyl-1,3-benzothiazole CAS Name: 5-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperidinyl]propoxy]-2-methyl-1,3-benzothiazole IUPAC Name: 5-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperidin-1-yl]propoxy]-2-methyl-1,3-benzothiazole Traditional Name: 2-methyl-5-[3-(4-piperonylpiperidino)propoxy]-1,3-benzothiazole Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCCCN3CCC(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OCCCN3CCC(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C24H28N2O3S/c1-17-25-21-15-20(4-6-24(21)30-17)27-12-2-9-26-10-7-18(8-11-26)13-19-3-5-22-23(14-19)29-16-28-22/h3-6,14-15,18H,2,7-13,16H2,1H3