5-methyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(3-morpholin-4-ylpropyl)pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(3-morpholin-4-ylpropyl)pyrazine-2-carboxamide Openeye Name: 5-methyl-N-(3-morpholinopropyl)-N-[3-[4-(o-tolyl)piperazin-1-yl]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-[3-[4-(2-methylphenyl)-1-piperazinyl]-3-oxopropyl]-N-[3-(4-morpholinyl)propyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-[3-[4-(2-methylphenyl)piperazin-1-yl]-3-oxopropyl]-N-(3-morpholin-4-ylpropyl)pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-[4-(o-tolyl)piperazino]propyl]-5-methyl-N-(3-morpholinopropyl)pyrazinamide Formula: C27H38N6O3 MolecularWeight: 494.62902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)CCN(CCCN3CCOCC3)C(=O)C4=CN=C(C=N4)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)CCN(CCCN3CCOCC3)C(=O)C4=CN=C(C=N4)C

InChI

InChI=1S/C27H38N6O3/c1-22-6-3-4-7-25(22)31-12-14-32(15-13-31)26(34)8-11-33(10-5-9-30-16-18-36-19-17-30)27(35)24-21-28-23(2)20-29-24/h3-4,6-7,20-21H,5,8-19H2,1-2H3