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

Systemtic Name: 3,3-dimethyl-8-(phenylmethylsulfanyl)-5-(1,3-thiazol-2-yl)-2,4-dihydronaphthalen-1-one Openeye Name: 8-benzylsulfanyl-3,3-dimethyl-5-thiazol-2-yl-tetralin-1-one CAS Name: 3,3-dimethyl-8-(phenylmethylthio)-5-(2-thiazolyl)-2,4-dihydronaphthalen-1-one IUPAC Name: 8-benzylsulfanyl-3,3-dimethyl-5-(1,3-thiazol-2-yl)-2,4-dihydronaphthalen-1-one Traditional Name: 8-(benzylthio)-3,3-dimethyl-5-thiazol-2-yl-tetralin-1-one Formula: C22H21NOS2 MolecularWeight: 379.53824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21NOS2/c1-22(2)12-17-16(21-23-10-11-25-21)8-9-19(20(17)18(24)13-22)26-14-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3