3,3-dimethyl-8-(pyridin-4-ylmethylsulfanyl)-5-(1,3-thiazol-2-yl)-2,4-dihydronaphthalen-1-one

Systemtic Name: 3,3-dimethyl-8-(pyridin-4-ylmethylsulfanyl)-5-(1,3-thiazol-2-yl)-2,4-dihydronaphthalen-1-one Openeye Name: 3,3-dimethyl-8-(4-pyridylmethylsulfanyl)-5-thiazol-2-yl-tetralin-1-one CAS Name: 3,3-dimethyl-8-(pyridin-4-ylmethylthio)-5-(2-thiazolyl)-2,4-dihydronaphthalen-1-one IUPAC Name: 3,3-dimethyl-8-(pyridin-4-ylmethylsulfanyl)-5-(1,3-thiazol-2-yl)-2,4-dihydronaphthalen-1-one Traditional Name: 3,3-dimethyl-8-(4-pyridylmethylthio)-5-thiazol-2-yl-tetralin-1-one Formula: C21H20N2OS2 MolecularWeight: 380.5263

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2C(=O)C1)SCC3=CC=NC=C3)C4=NC=CS4)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2C(=O)C1)SCC3=CC=NC=C3)C4=NC=CS4)C

InChI

InChI=1S/C21H20N2OS2/c1-21(2)11-16-15(20-23-9-10-25-20)3-4-18(19(16)17(24)12-21)26-13-14-5-7-22-8-6-14/h3-10H,11-13H2,1-2H3