2-(4-butylpiperazin-1-yl)-N-methyl-3-morpholin-4-yl-2-pyridin-2-ylsulfanyl-propanamide

Systemtic Name: 2-(4-butylpiperazin-1-yl)-N-methyl-3-morpholin-4-yl-2-pyridin-2-ylsulfanyl-propanamide Openeye Name: 2-(4-butylpiperazin-1-yl)-N-methyl-3-morpholino-2-(2-pyridylsulfanyl)propanamide CAS Name: 2-(4-butyl-1-piperazinyl)-N-methyl-3-(4-morpholinyl)-2-(2-pyridinylthio)propanamide IUPAC Name: 2-(4-butylpiperazin-1-yl)-N-methyl-3-morpholin-4-yl-2-pyridin-2-ylsulfanylpropanamide Traditional Name: 2-(4-butylpiperazino)-N-methyl-3-morpholino-2-(2-pyridylthio)propionamide Formula: C21H35N5O2S MolecularWeight: 421.5999

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(CC1)C(CN2CCOCC2)(C(=O)NC)SC3=CC=CC=N3

Isomeric SMILES

CCCCN1CCN(CC1)C(CN2CCOCC2)(C(=O)NC)SC3=CC=CC=N3

InChI

InChI=1S/C21H35N5O2S/c1-3-4-9-24-10-12-26(13-11-24)21(20(27)22-2,18-25-14-16-28-17-15-25)29-19-7-5-6-8-23-19/h5-8H,3-4,9-18H2,1-2H3,(H,22,27)