[2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]thiazol-4-yl]-(4-benzyl-1-piperidyl)methanone CAS Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-4-thiazolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: [2-[[1,3-benzodioxol-5-ylmethyl-[(2,4-dimethoxyphenyl)methyl]amino]methyl]-1,3-thiazol-4-yl]-(4-benzylpiperidin-1-yl)methanone Traditional Name: (4-benzylpiperidino)-[2-[[(2,4-dimethoxybenzyl)-piperonyl-amino]methyl]thiazol-4-yl]methanone Formula: C34H37N3O5S MolecularWeight: 599.73968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)N5CCC(CC5)CC6=CC=CC=C6)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CC2=CC3=C(C=C2)OCO3)CC4=NC(=CS4)C(=O)N5CCC(CC5)CC6=CC=CC=C6)OC

InChI

InChI=1S/C34H37N3O5S/c1-39-28-10-9-27(31(18-28)40-2)20-36(19-26-8-11-30-32(17-26)42-23-41-30)21-33-35-29(22-43-33)34(38)37-14-12-25(13-15-37)16-24-6-4-3-5-7-24/h3-11,17-18,22,25H,12-16,19-21,23H2,1-2H3