2-(3-chloranyl-4-methylsulfonyl-phenyl)-N-[5-(cyanomethyl)pyrazin-2-yl]-3-cyclopentyl-propanamide

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)-N-[5-(cyanomethyl)pyrazin-2-yl]-3-cyclopentyl-propanamide Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)-N-[5-(cyanomethyl)pyrazin-2-yl]-3-cyclopentyl-propanamide CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)-N-[5-(cyanomethyl)-2-pyrazinyl]-3-cyclopentylpropanamide IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)-N-[5-(cyanomethyl)pyrazin-2-yl]-3-cyclopentylpropanamide Traditional Name: 2-(3-chloro-4-mesyl-phenyl)-N-[5-(cyanomethyl)pyrazin-2-yl]-3-cyclopentyl-propionamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC=C(N=C3)CC#N)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCCC2)C(=O)NC3=NC=C(N=C3)CC#N)Cl

InChI

InChI=1S/C21H23ClN4O3S/c1-30(28,29)19-7-6-15(11-18(19)22)17(10-14-4-2-3-5-14)21(27)26-20-13-24-16(8-9-23)12-25-20/h6-7,11-14,17H,2-5,8,10H2,1H3,(H,25,26,27)