3-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]but-2-enamide

Systemtic Name: 3-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]but-2-enamide Openeye Name: 3-methyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]but-2-enamide CAS Name: 3-methyl-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-2-butenamide IUPAC Name: 3-methyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]but-2-enamide Traditional Name: 3-methyl-N-(5-nosylthiazol-2-yl)but-2-enamide Formula: C14H13N3O5S2 MolecularWeight: 367.40012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=CC(=O)NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C14H13N3O5S2/c1-9(2)7-12(18)16-14-15-8-13(23-14)24(21,22)11-5-3-10(4-6-11)17(19)20/h3-8H,1-2H3,(H,15,16,18)