N-(2,3-dihydro-1H-inden-5-yl)-2-[[2-(4-ethanoylpiperazin-1-yl)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1H-inden-5-yl)-2-[[2-(4-ethanoylpiperazin-1-yl)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide Openeye Name: 2-[[2-(4-acetylpiperazin-1-yl)-4-pyridyl]methylsulfanyl]-N-indan-5-yl-pyridine-3-carboxamide CAS Name: 2-[[2-(4-acetyl-1-piperazinyl)-4-pyridinyl]methylthio]-N-(2,3-dihydro-1H-inden-5-yl)-3-pyridinecarboxamide IUPAC Name: 2-[[2-(4-acetylpiperazin-1-yl)pyridin-4-yl]methylsulfanyl]-N-(2,3-dihydro-1H-inden-5-yl)pyridine-3-carboxamide Traditional Name: 2-[[2-(4-acetylpiperazino)-4-pyridyl]methylthio]-N-indan-5-yl-nicotinamide Formula: C27H29N5O2S MolecularWeight: 487.61646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC=CC(=C2)CSC3=C(C=CC=N3)C(=O)NC4=CC5=C(CCC5)C=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC=CC(=C2)CSC3=C(C=CC=N3)C(=O)NC4=CC5=C(CCC5)C=C4

InChI

InChI=1S/C27H29N5O2S/c1-19(33)31-12-14-32(15-13-31)25-16-20(9-11-28-25)18-35-27-24(6-3-10-29-27)26(34)30-23-8-7-21-4-2-5-22(21)17-23/h3,6-11,16-17H,2,4-5,12-15,18H2,1H3,(H,30,34)