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

Systemtic Name: 2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-(oxolan-3-yl)-N-pyrazin-2-yl-propanamide Openeye Name: 2-(3-chloro-4-methylsulfonyl-phenyl)-N-pyrazin-2-yl-3-tetrahydrofuran-3-yl-propanamide CAS Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(3-oxolanyl)-N-(2-pyrazinyl)propanamide IUPAC Name: 2-(3-chloro-4-methylsulfonylphenyl)-3-(oxolan-3-yl)-N-pyrazin-2-ylpropanamide Traditional Name: 2-(3-chloro-4-mesyl-phenyl)-N-pyrazin-2-yl-3-tetrahydrofuran-3-yl-propionamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCOC2)C(=O)NC3=NC=CN=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C=C1)C(CC2CCOC2)C(=O)NC3=NC=CN=C3)Cl

InChI

InChI=1S/C18H20ClN3O4S/c1-27(24,25)16-3-2-13(9-15(16)19)14(8-12-4-7-26-11-12)18(23)22-17-10-20-5-6-21-17/h2-3,5-6,9-10,12,14H,4,7-8,11H2,1H3,(H,21,22,23)