1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-phenyl-2-phenylazanyl-1,3-thiazol-5-yl)ethanone

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-phenyl-2-phenylazanyl-1,3-thiazol-5-yl)ethanone Openeye Name: 2-(2-anilino-4-phenyl-thiazol-5-yl)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanone CAS Name: 2-(2-anilino-4-phenyl-5-thiazolyl)-1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-anilino-4-phenyl-1,3-thiazol-5-yl)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-anilino-4-phenyl-thiazol-5-yl)-1-(4-piperonylpiperazino)ethanone Formula: C29H28N4O3S MolecularWeight: 512.62262

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CC4=C(N=C(S4)NC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CC4=C(N=C(S4)NC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H28N4O3S/c34-27(33-15-13-32(14-16-33)19-21-11-12-24-25(17-21)36-20-35-24)18-26-28(22-7-3-1-4-8-22)31-29(37-26)30-23-9-5-2-6-10-23/h1-12,17H,13-16,18-20H2,(H,30,31)