(E)-N-butan-2-yl-3-(4-nitrophenyl)-N-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]prop-2-enamide

Systemtic Name: (E)-N-butan-2-yl-3-(4-nitrophenyl)-N-[2-oxidanylidene-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]prop-2-enamide Openeye Name: (E)-3-(4-nitrophenyl)-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-N-sec-butyl-prop-2-enamide CAS Name: (E)-N-butan-2-yl-3-(4-nitrophenyl)-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-2-propenamide IUPAC Name: (E)-N-butan-2-yl-3-(4-nitrophenyl)-N-[2-oxo-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]prop-2-enamide Traditional Name: (E)-N-[2-keto-2-(4-phenyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-3-(4-nitrophenyl)-N-sec-butyl-acrylamide Formula: C28H29N3O4S MolecularWeight: 503.61256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=CS2)C(=O)C=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=CS2)C(=O)/C=C/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H29N3O4S/c1-3-20(2)30(26(32)14-11-21-9-12-23(13-10-21)31(34)35)19-27(33)29-17-15-25-24(16-18-36-25)28(29)22-7-5-4-6-8-22/h4-14,16,18,20,28H,3,15,17,19H2,1-2H3/b14-11+