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

Systemtic Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-4-ethoxy-3-nitro-benzamide Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2)N3CCC4=C(C3)C=CS4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(C2=CC=CC=C2)N3CCC4=C(C3)C=CS4)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O4S/c1-2-31-22-9-8-18(14-20(22)27(29)30)24(28)25-15-21(17-6-4-3-5-7-17)26-12-10-23-19(16-26)11-13-32-23/h3-9,11,13-14,21H,2,10,12,15-16H2,1H3,(H,25,28)