3,5-dimethoxy-N-[6-[4-(2-oxidanyl-3-prop-2-ynoxy-propyl)piperazin-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[6-[4-(2-oxidanyl-3-prop-2-ynoxy-propyl)piperazin-1-yl]pyridin-3-yl]benzamide Openeye Name: N-[6-[4-(2-hydroxy-3-prop-2-ynoxy-propyl)piperazin-1-yl]-3-pyridyl]-3,5-dimethoxy-benzamide CAS Name: N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)-1-piperazinyl]-3-pyridinyl]-3,5-dimethoxybenzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)piperazin-1-yl]pyridin-3-yl]-3,5-dimethoxybenzamide Traditional Name: N-[6-[4-(2-hydroxy-3-propargyloxy-propyl)piperazino]-3-pyridyl]-3,5-dimethoxy-benzamide Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC#C)O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC#C)O)OC

InChI

InChI=1S/C24H30N4O5/c1-4-11-33-17-20(29)16-27-7-9-28(10-8-27)23-6-5-19(15-25-23)26-24(30)18-12-21(31-2)14-22(13-18)32-3/h1,5-6,12-15,20,29H,7-11,16-17H2,2-3H3,(H,26,30)