N-[2-[[5-(6-azanylpyridin-3-yl)-1-(4-ethylpiperidin-3-yl)-1-oxidanylidene-pentan-2-yl]sulfamoyl]-6-thiophen-2-yl-phenyl]propanamide

Systemtic Name: N-[2-[[5-(6-azanylpyridin-3-yl)-1-(4-ethylpiperidin-3-yl)-1-oxidanylidene-pentan-2-yl]sulfamoyl]-6-thiophen-2-yl-phenyl]propanamide Openeye Name: N-[2-[[4-(6-amino-3-pyridyl)-1-(4-ethylpiperidine-3-carbonyl)butyl]sulfamoyl]-6-(2-thienyl)phenyl]propanamide CAS Name: N-[2-[[5-(6-amino-3-pyridinyl)-1-(4-ethyl-3-piperidinyl)-1-oxopentan-2-yl]sulfamoyl]-6-thiophen-2-ylphenyl]propanamide IUPAC Name: N-[2-[[5-(6-aminopyridin-3-yl)-1-(4-ethylpiperidin-3-yl)-1-oxopentan-2-yl]sulfamoyl]-6-thiophen-2-ylphenyl]propanamide Traditional Name: N-[2-[[4-(6-amino-3-pyridyl)-1-(4-ethylnipecotoyl)butyl]sulfamoyl]-6-(2-thienyl)phenyl]propionamide Formula: C30H39N5O4S2 MolecularWeight: 597.79176

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCNCC1C(=O)C(CCCC2=CN=C(C=C2)N)NS(=O)(=O)C3=CC=CC(=C3NC(=O)CC)C4=CC=CS4

Isomeric SMILES

CCC1CCNCC1C(=O)C(CCCC2=CN=C(C=C2)N)NS(=O)(=O)C3=CC=CC(=C3NC(=O)CC)C4=CC=CS4

InChI

InChI=1S/C30H39N5O4S2/c1-3-21-15-16-32-19-23(21)30(37)24(10-5-8-20-13-14-27(31)33-18-20)35-41(38,39)26-12-6-9-22(25-11-7-17-40-25)29(26)34-28(36)4-2/h6-7,9,11-14,17-18,21,23-24,32,35H,3-5,8,10,15-16,19H2,1-2H3,(H2,31,33)(H,34,36)