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

Systemtic Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-3-methyl-2-nitro-benzamide Openeye Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-3-methyl-2-nitro-benzamide CAS Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenylethyl]-3-methyl-2-nitrobenzamide Traditional Name: N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-phenyl-ethyl]-3-methyl-2-nitro-benzamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3S/c1-16-6-5-9-19(22(16)26(28)29)23(27)24-14-20(17-7-3-2-4-8-17)25-12-10-21-18(15-25)11-13-30-21/h2-9,11,13,20H,10,12,14-15H2,1H3,(H,24,27)