4-(4-chloranyl-3-methyl-phenoxy)-1-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butan-1-one

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-1-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butan-1-one Openeye Name: 4-(4-chloro-3-methyl-phenoxy)-1-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]butan-1-one CAS Name: 4-(4-chloro-3-methylphenoxy)-1-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-butanone IUPAC Name: 4-(4-chloro-3-methylphenoxy)-1-(4-thiophen-2-yl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butan-1-one Traditional Name: 4-(4-chloro-3-methyl-phenoxy)-1-[4-(2-thienyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]butan-1-one Formula: C22H22ClNO2S2 MolecularWeight: 431.99858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)N2CCC3=C(C2C4=CC=CS4)C=CS3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)N2CCC3=C(C2C4=CC=CS4)C=CS3)Cl

InChI

InChI=1S/C22H22ClNO2S2/c1-15-14-16(6-7-18(15)23)26-11-2-5-21(25)24-10-8-19-17(9-13-28-19)22(24)20-4-3-12-27-20/h3-4,6-7,9,12-14,22H,2,5,8,10-11H2,1H3