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

Systemtic Name: N-[2-(2-bromanyl-4,6-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-4-nitro-benzamide Openeye Name: N-[2-(2-bromo-4,6-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-4-nitro-benzamide CAS Name: N-[2-(2-bromo-4,6-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-4-nitrobenzamide IUPAC Name: N-[2-(2-bromo-4,6-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-4-nitrobenzamide Traditional Name: N-[2-(2-bromo-4,6-dimethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-4-nitro-benzamide Formula: C18H20BrN3O3S MolecularWeight: 438.3387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=C(S2)Br)C(N1CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC2=C(C=C(S2)Br)C(N1CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20BrN3O3S/c1-11-9-16-15(10-17(19)26-16)12(2)21(11)8-7-20-18(23)13-3-5-14(6-4-13)22(24)25/h3-6,10-12H,7-9H2,1-2H3,(H,20,23)