1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-[(4-nitrophenyl)amino]butan-1-one

Systemtic Name: 1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-[(4-nitrophenyl)amino]butan-1-one Openeye Name: 1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-(4-nitroanilino)butan-1-one CAS Name: 1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-(4-nitroanilino)-1-butanone IUPAC Name: 1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-(4-nitroanilino)butan-1-one Traditional Name: 1-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-(4-nitroanilino)butan-1-one Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-])SC=C2

Isomeric SMILES

CCC1C2=C(CCN1C(=O)CCCNC3=CC=C(C=C3)[N+](=O)[O-])SC=C2

InChI

InChI=1S/C19H23N3O3S/c1-2-17-16-10-13-26-18(16)9-12-21(17)19(23)4-3-11-20-14-5-7-15(8-6-14)22(24)25/h5-8,10,13,17,20H,2-4,9,11-12H2,1H3