2-cyano-N-[(E)-3-(5-methylsulfonylfuran-2-yl)prop-2-enoyl]aziridine-1-carboxamide

Systemtic Name: 2-cyano-N-[(E)-3-(5-methylsulfonylfuran-2-yl)prop-2-enoyl]aziridine-1-carboxamide Openeye Name: 2-cyano-N-[(E)-3-(5-methylsulfonyl-2-furyl)prop-2-enoyl]aziridine-1-carboxamide CAS Name: 2-cyano-N-[(E)-3-(5-methylsulfonyl-2-furanyl)-1-oxoprop-2-enyl]-1-aziridinecarboxamide IUPAC Name: 2-cyano-N-[(E)-3-(5-methylsulfonylfuran-2-yl)prop-2-enoyl]aziridine-1-carboxamide Traditional Name: 2-cyano-N-[(E)-3-(5-mesyl-2-furyl)acryloyl]ethylenimine-1-carboxamide Formula: C12H11N3O5S MolecularWeight: 309.29784

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(O1)C=CC(=O)NC(=O)N2CC2C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(O1)/C=C/C(=O)NC(=O)N2CC2C#N

InChI

InChI=1S/C12H11N3O5S/c1-21(18,19)11-5-3-9(20-11)2-4-10(16)14-12(17)15-7-8(15)6-13/h2-5,8H,7H2,1H3,(H,14,16,17)/b4-2+