2-(4-ethanoyl-2-methoxy-phenoxy)-1-[(4S)-4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone

Systemtic Name: 2-(4-ethanoyl-2-methoxy-phenoxy)-1-[(4S)-4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Openeye Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[(4S)-4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone CAS Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[(4S)-4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone IUPAC Name: 2-(4-acetyl-2-methoxyphenoxy)-1-[(4S)-4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)-1-[(4S)-4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]ethanone Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCC3=C(C2C4=CC=CS4)C=CS3)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)N2CCC3=C([C@H]2C4=CC=CS4)C=CS3)OC

InChI

InChI=1S/C22H21NO4S2/c1-14(24)15-5-6-17(18(12-15)26-2)27-13-21(25)23-9-7-19-16(8-11-29-19)22(23)20-4-3-10-28-20/h3-6,8,10-12,22H,7,9,13H2,1-2H3/t22-/m0/s1