(E)-3-(4-chloranyl-3-nitro-phenyl)-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-N-(3-cyano-4,5-dimethyl-thiophen-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)prop-2-enamide CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-propenamide IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)acrylamide Formula: C16H12ClN3O3S MolecularWeight: 361.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C16H12ClN3O3S/c1-9-10(2)24-16(12(9)8-18)19-15(21)6-4-11-3-5-13(17)14(7-11)20(22)23/h3-7H,1-2H3,(H,19,21)/b6-4+