N-(3-chloranyl-4-methylsulfonyl-phenyl)-N-(5-methylpyrazin-2-yl)-3-(4-oxidanylidenecyclohexyl)propanamide

Systemtic Name: N-(3-chloranyl-4-methylsulfonyl-phenyl)-N-(5-methylpyrazin-2-yl)-3-(4-oxidanylidenecyclohexyl)propanamide Openeye Name: N-(3-chloro-4-methylsulfonyl-phenyl)-N-(5-methylpyrazin-2-yl)-3-(4-oxocyclohexyl)propanamide CAS Name: N-(3-chloro-4-methylsulfonylphenyl)-N-(5-methyl-2-pyrazinyl)-3-(4-oxocyclohexyl)propanamide IUPAC Name: N-(3-chloro-4-methylsulfonylphenyl)-N-(5-methylpyrazin-2-yl)-3-(4-oxocyclohexyl)propanamide Traditional Name: N-(3-chloro-4-mesyl-phenyl)-3-(4-ketocyclohexyl)-N-(5-methylpyrazin-2-yl)propionamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCC(=O)CC3

Isomeric SMILES

CC1=CN=C(C=N1)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCC(=O)CC3

InChI

InChI=1S/C21H24ClN3O4S/c1-14-12-24-20(13-23-14)25(16-6-9-19(18(22)11-16)30(2,28)29)21(27)10-5-15-3-7-17(26)8-4-15/h6,9,11-13,15H,3-5,7-8,10H2,1-2H3