4,6-dimethyl-2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-2-[4-(5-morpholinosulfonyl-2-pyridyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-2-[4-[5-(4-morpholinylsulfonyl)-2-pyridinyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-2-[4-(5-morpholin-4-ylsulfonylpyridin-2-yl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-2-[4-(5-morpholinosulfonyl-2-pyridyl)piperazino]nicotinonitrile Formula: C21H26N6O3S MolecularWeight: 442.53454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)N2CCN(CC2)C3=NC=C(C=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C21H26N6O3S/c1-16-13-17(2)24-21(19(16)14-22)26-7-5-25(6-8-26)20-4-3-18(15-23-20)31(28,29)27-9-11-30-12-10-27/h3-4,13,15H,5-12H2,1-2H3