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

Systemtic Name: 2-chloranyl-N-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylcarbonyl)-2-methyl-phenyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-2-methyl-phenyl]-4-nitro-benzamide CAS Name: 2-chloro-N-[3-[6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl(oxo)methyl]-2-methylphenyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-2-methylphenyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-2-methyl-phenyl]-4-nitro-benzamide Formula: C22H18ClN3O4S MolecularWeight: 455.91402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)N3CCC4=C(C3)C=CS4

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)N3CCC4=C(C3)C=CS4

InChI

InChI=1S/C22H18ClN3O4S/c1-13-16(22(28)25-9-7-20-14(12-25)8-10-31-20)3-2-4-19(13)24-21(27)17-6-5-15(26(29)30)11-18(17)23/h2-6,8,10-11H,7,9,12H2,1H3,(H,24,27)