2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[(1-morpholin-4-ylcycloheptyl)methyl]-6-thiophen-3-yl-pyridine-3-carboxamide

Systemtic Name: 2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[(1-morpholin-4-ylcycloheptyl)methyl]-6-thiophen-3-yl-pyridine-3-carboxamide Openeye Name: 2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[(1-morpholinocycloheptyl)methyl]-6-(3-thienyl)pyridine-3-carboxamide CAS Name: 2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[[1-(4-morpholinyl)cycloheptyl]methyl]-6-(3-thiophenyl)-3-pyridinecarboxamide IUPAC Name: 2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[(1-morpholin-4-ylcycloheptyl)methyl]-6-thiophen-3-ylpyridine-3-carboxamide Traditional Name: 2-[1,4-dioxan-2-ylmethyl(methyl)amino]-N-[(1-morpholinocycloheptyl)methyl]-6-(3-thienyl)nicotinamide Formula: C28H40N4O4S MolecularWeight: 528.7066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COCCO1)C2=C(C=CC(=N2)C3=CSC=C3)C(=O)NCC4(CCCCCC4)N5CCOCC5

Isomeric SMILES

CN(CC1COCCO1)C2=C(C=CC(=N2)C3=CSC=C3)C(=O)NCC4(CCCCCC4)N5CCOCC5

InChI

InChI=1S/C28H40N4O4S/c1-31(18-23-19-35-15-16-36-23)26-24(6-7-25(30-26)22-8-17-37-20-22)27(33)29-21-28(9-4-2-3-5-10-28)32-11-13-34-14-12-32/h6-8,17,20,23H,2-5,9-16,18-19,21H2,1H3,(H,29,33)