N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-(piperidin-1-ylmethyl)benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-(piperidin-1-ylmethyl)benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-4-(1-piperidylmethyl)benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-(1-piperidinylmethyl)benzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-(piperidin-1-ylmethyl)benzamide Traditional Name: N-(4-methyl-5-piperonyl-thiazol-2-yl)-4-(piperidinomethyl)benzamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CN3CCCCC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CN3CCCCC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H27N3O3S/c1-17-23(14-19-7-10-21-22(13-19)31-16-30-21)32-25(26-17)27-24(29)20-8-5-18(6-9-20)15-28-11-3-2-4-12-28/h5-10,13H,2-4,11-12,14-16H2,1H3,(H,26,27,29)