2-[5-cyano-3-cyclopropyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide

Systemtic Name: 2-[5-cyano-3-cyclopropyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]ethanamide Openeye Name: 2-(5-cyano-3-cyclopropyl-2,6-dioxo-pyrimidin-1-yl)-N-[(4-morpholinosulfonylphenyl)methyl]acetamide CAS Name: 2-(5-cyano-3-cyclopropyl-2,6-dioxo-1-pyrimidinyl)-N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]acetamide IUPAC Name: 2-(5-cyano-3-cyclopropyl-2,6-dioxopyrimidin-1-yl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]acetamide Traditional Name: 2-(5-cyano-3-cyclopropyl-2,6-diketo-pyrimidin-1-yl)-N-(4-morpholinosulfonylbenzyl)acetamide Formula: C21H23N5O6S MolecularWeight: 473.50222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)N(C2=O)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

Isomeric SMILES

C1CC1N2C=C(C(=O)N(C2=O)CC(=O)NCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

InChI

InChI=1S/C21H23N5O6S/c22-11-16-13-25(17-3-4-17)21(29)26(20(16)28)14-19(27)23-12-15-1-5-18(6-2-15)33(30,31)24-7-9-32-10-8-24/h1-2,5-6,13,17H,3-4,7-10,12,14H2,(H,23,27)