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

Systemtic Name: N-(3-chloranyl-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[(6E)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide Openeye Name: N-(3-chloro-4-methylsulfonyl-phenyl)-3-cyclopentyl-N-[(6E)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide CAS Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[(6E)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide IUPAC Name: N-(3-chloro-4-methylsulfonylphenyl)-3-cyclopentyl-N-[(6E)-6-(1-nitrosoethylidene)-1H-pyrazin-3-yl]propanamide Traditional Name: N-(3-chloro-4-mesyl-phenyl)-3-cyclopentyl-N-[(6E)-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)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCCC3)N=O

Isomeric SMILES

C/C(=C\1/C=NC(=CN1)N(C2=CC(=C(C=C2)S(=O)(=O)C)Cl)C(=O)CCC3CCCC3)/N=O

InChI

InChI=1S/C21H25ClN4O4S/c1-14(25-28)18-12-24-20(13-23-18)26(21(27)10-7-15-5-3-4-6-15)16-8-9-19(17(22)11-16)31(2,29)30/h8-9,11-13,15,23H,3-7,10H2,1-2H3/b18-14+