N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-keto-ethyl]-3-nitro-benzamide Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])SC=C2

Isomeric SMILES

CCC1C2=C(CCN1C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])SC=C2

InChI

InChI=1S/C18H19N3O4S/c1-2-15-14-7-9-26-16(14)6-8-20(15)17(22)11-19-18(23)12-4-3-5-13(10-12)21(24)25/h3-5,7,9-10,15H,2,6,8,11H2,1H3,(H,19,23)