2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)butanamide

Systemtic Name: 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Openeye Name: 2-(2-methyl-6-phenyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholinosulfonylphenyl)butanamide CAS Name: 2-[(2-methyl-6-phenyl-4-pyrimidinyl)thio]-N-[4-(4-morpholinylsulfonyl)phenyl]butanamide IUPAC Name: 2-(2-methyl-6-phenylpyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)butanamide Traditional Name: 2-[(2-methyl-6-phenyl-pyrimidin-4-yl)thio]-N-(4-morpholinosulfonylphenyl)butyramide Formula: C25H28N4O4S2 MolecularWeight: 512.64422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)SC3=NC(=NC(=C3)C4=CC=CC=C4)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)SC3=NC(=NC(=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H28N4O4S2/c1-3-23(34-24-17-22(26-18(2)27-24)19-7-5-4-6-8-19)25(30)28-20-9-11-21(12-10-20)35(31,32)29-13-15-33-16-14-29/h4-12,17,23H,3,13-16H2,1-2H3,(H,28,30)