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

Systemtic Name: 4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzenecarbonitrile Openeye Name: 4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzonitrile CAS Name: 4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitrobenzonitrile IUPAC Name: 4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitrobenzonitrile Traditional Name: 4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-nitro-benzonitrile Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C3=C(C=C(C=C3)C#N)[N+](=O)[O-])SC=C2

Isomeric SMILES

CCC1C2=C(CCN1C3=C(C=C(C=C3)C#N)[N+](=O)[O-])SC=C2

InChI

InChI=1S/C16H15N3O2S/c1-2-13-12-6-8-22-16(12)5-7-18(13)14-4-3-11(10-17)9-15(14)19(20)21/h3-4,6,8-9,13H,2,5,7H2,1H3