5-[[(E)-3-(2-chloranyl-5-nitro-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N-ethyl-3-methyl-thiophene-2-carboxamide

Systemtic Name: 5-[[(E)-3-(2-chloranyl-5-nitro-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N-ethyl-3-methyl-thiophene-2-carboxamide Openeye Name: 5-[[(E)-3-(2-chloro-5-nitro-phenyl)-2-cyano-prop-2-enoyl]amino]-4-cyano-N-ethyl-3-methyl-thiophene-2-carboxamide CAS Name: 5-[[(E)-3-(2-chloro-5-nitrophenyl)-2-cyano-1-oxoprop-2-enyl]amino]-4-cyano-N-ethyl-3-methyl-2-thiophenecarboxamide IUPAC Name: 5-[[(E)-3-(2-chloro-5-nitrophenyl)-2-cyanoprop-2-enoyl]amino]-4-cyano-N-ethyl-3-methylthiophene-2-carboxamide Traditional Name: 5-[[(E)-3-(2-chloro-5-nitro-phenyl)-2-cyano-acryloyl]amino]-4-cyano-N-ethyl-3-methyl-thiophene-2-carboxamide Formula: C19H14ClN5O4S MolecularWeight: 443.86356

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(C(=C(S1)NC(=O)C(=CC2=C(C=CC(=C2)[N+](=O)[O-])Cl)C#N)C#N)C

Isomeric SMILES

CCNC(=O)C1=C(C(=C(S1)NC(=O)/C(=C/C2=C(C=CC(=C2)[N+](=O)[O-])Cl)/C#N)C#N)C

InChI

InChI=1S/C19H14ClN5O4S/c1-3-23-18(27)16-10(2)14(9-22)19(30-16)24-17(26)12(8-21)6-11-7-13(25(28)29)4-5-15(11)20/h4-7H,3H2,1-2H3,(H,23,27)(H,24,26)/b12-6+