(2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide

Systemtic Name: (2R)-2-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide Openeye Name: (2R)-2-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide CAS Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide IUPAC Name: (2R)-2-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide Traditional Name: (2R)-2-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-N-[(6Z)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propionamide Formula: C21H25ClN4O4S MolecularWeight: 464.9656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=NC(=CN1)NC(=O)C(CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)Cl)N=O

Isomeric SMILES

C/C(=C/1\C=NC(=CN1)NC(=O)[C@H](CC2CCCC2)C3=CC(=C(C=C3)S(=O)(=O)C)Cl)/N=O

InChI

InChI=1S/C21H25ClN4O4S/c1-13(26-28)18-11-24-20(12-23-18)25-21(27)16(9-14-5-3-4-6-14)15-7-8-19(17(22)10-15)31(2,29)30/h7-8,10-12,14,16,23H,3-6,9H2,1-2H3,(H,25,27)/b18-13-/t16-/m1/s1