4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazole

Systemtic Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazole Openeye Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-(4-ethoxy-3-methoxy-phenyl)thiazole CAS Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]methyl]-2-(4-ethoxy-3-methoxyphenyl)thiazole IUPAC Name: 4-[[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl]-2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazole Traditional Name: 2-(4-ethoxy-3-methoxy-phenyl)-4-[(4-piperonylpiperazino)methyl]thiazole Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)OC

InChI

InChI=1S/C25H29N3O4S/c1-3-30-21-7-5-19(13-23(21)29-2)25-26-20(16-33-25)15-28-10-8-27(9-11-28)14-18-4-6-22-24(12-18)32-17-31-22/h4-7,12-13,16H,3,8-11,14-15,17H2,1-2H3