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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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