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

Systemtic Name: 2-methyl-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]-2-methyl-benzamide CAS Name: N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)-1-piperazinyl]-3-pyridinyl]-2-methylbenzamide IUPAC Name: N-[6-[4-(2-hydroxy-3-prop-2-ynoxypropyl)piperazin-1-yl]pyridin-3-yl]-2-methylbenzamide Traditional Name: N-[6-[4-(2-hydroxy-3-propargyloxy-propyl)piperazino]-3-pyridyl]-2-methyl-benzamide Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC#C)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CN=C(C=C2)N3CCN(CC3)CC(COCC#C)O

InChI

InChI=1S/C23H28N4O3/c1-3-14-30-17-20(28)16-26-10-12-27(13-11-26)22-9-8-19(15-24-22)25-23(29)21-7-5-4-6-18(21)2/h1,4-9,15,20,28H,10-14,16-17H2,2H3,(H,25,29)