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

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(4-oxidanylidenecyclohexyl)-N-pyrazin-2-yl-propanamide Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)-3-(4-oxocyclohexyl)-N-pyrazin-2-yl-propanamide CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(4-oxocyclohexyl)-N-(2-pyrazinyl)propanamide IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(4-oxocyclohexyl)-N-pyrazin-2-ylpropanamide Traditional Name: 2-(3-chloro-4-mesyl-phenyl)-3-(4-ketocyclohexyl)-N-pyrazin-2-yl-propionamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCC(=O)CC2)C(=O)NC3=NC=CN=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCC(=O)CC2)C(=O)NC3=NC=CN=C3)Cl

InChI

InChI=1S/C20H22ClN3O4S/c1-29(27,28)18-7-4-14(11-17(18)21)16(10-13-2-5-15(25)6-3-13)20(26)24-19-12-22-8-9-23-19/h4,7-9,11-13,16H,2-3,5-6,10H2,1H3,(H,23,24,26)