N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-(5-prop-2-enylpyrazin-2-yl)propanamide

Systemtic Name: N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-(5-prop-2-enylpyrazin-2-yl)propanamide Openeye Name: N-(5-allylpyrazin-2-yl)-N-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-propanamide CAS Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-(5-prop-2-enyl-2-pyrazinyl)propanamide IUPAC Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-(5-prop-2-enylpyrazin-2-yl)propanamide Traditional Name: N-(5-allylpyrazin-2-yl)-N-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-propionamide Formula: C22H26ClN3O3S MolecularWeight: 447.97814

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=NC=C(N=C2)CC=C)C(=O)CCC3CCCC3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)N(C2=NC=C(N=C2)CC=C)C(=O)CCC3CCCC3)Cl

InChI

InChI=1S/C22H26ClN3O3S/c1-3-6-17-14-25-21(15-24-17)26(22(27)12-9-16-7-4-5-8-16)18-10-11-20(19(23)13-18)30(2,28)29/h3,10-11,13-16H,1,4-9,12H2,2H3