3-[6-[(3-cyano-5-methyl-phenyl)amino]-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-1-yl]propane-1-sulfonamide

Systemtic Name: 3-[6-[(3-cyano-5-methyl-phenyl)amino]-2,4-bis(oxidanylidene)-5-propan-2-yl-pyrimidin-1-yl]propane-1-sulfonamide Openeye Name: 3-[6-(3-cyano-5-methyl-anilino)-5-isopropyl-2,4-dioxo-pyrimidin-1-yl]propane-1-sulfonamide CAS Name: 3-[6-(3-cyano-5-methylanilino)-2,4-dioxo-5-propan-2-yl-1-pyrimidinyl]-1-propanesulfonamide IUPAC Name: 3-[6-(3-cyano-5-methylanilino)-2,4-dioxo-5-propan-2-ylpyrimidin-1-yl]propane-1-sulfonamide Traditional Name: 3-[6-(3-cyano-5-methyl-anilino)-5-isopropyl-2,4-diketo-pyrimidin-1-yl]propane-1-sulfonamide Formula: C18H23N5O4S MolecularWeight: 405.47132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)NC2=C(C(=O)NC(=O)N2CCCS(=O)(=O)N)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)NC2=C(C(=O)NC(=O)N2CCCS(=O)(=O)N)C(C)C

InChI

InChI=1S/C18H23N5O4S/c1-11(2)15-16(21-14-8-12(3)7-13(9-14)10-19)23(18(25)22-17(15)24)5-4-6-28(20,26)27/h7-9,11,21H,4-6H2,1-3H3,(H2,20,26,27)(H,22,24,25)