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

Systemtic Name: N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-yl]-3-methyl-2-nitro-benzamide Openeye Name: N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridyl]-3-methyl-2-nitro-benzamide CAS Name: N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridinyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyridin-3-yl]-3-methyl-2-nitrobenzamide Traditional Name: N-[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridyl]-3-methyl-2-nitro-benzamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CN=C(C=C2)N3CCC4=C(C3)C=CS4

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CN=C(C=C2)N3CCC4=C(C3)C=CS4

InChI

InChI=1S/C20H18N4O3S/c1-13-3-2-4-16(19(13)24(26)27)20(25)22-15-5-6-18(21-11-15)23-9-7-17-14(12-23)8-10-28-17/h2-6,8,10-11H,7,9,12H2,1H3,(H,22,25)