3a,6a-dimethyl-3,6-bis(phenylsulfanyl)-1,4-dihydropentalene

Systemtic Name: 3a,6a-dimethyl-3,6-bis(phenylsulfanyl)-1,4-dihydropentalene Openeye Name: 3a,6a-dimethyl-3,6-bis(phenylsulfanyl)-1,4-dihydropentalene CAS Name: 3a,6a-dimethyl-3,6-bis(phenylthio)-1,4-dihydropentalene IUPAC Name: 3a,6a-dimethyl-3,6-bis(phenylsulfanyl)-1,4-dihydropentalene Traditional Name: 3a,6a-dimethyl-3,6-bis(phenylthio)-1,4-dihydropentalene Formula: C22H22S2 MolecularWeight: 350.54008

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC=C(C1(CC=C2SC3=CC=CC=C3)C)SC4=CC=CC=C4

Isomeric SMILES

CC12CC=C(C1(CC=C2SC3=CC=CC=C3)C)SC4=CC=CC=C4

InChI

InChI=1S/C22H22S2/c1-21-15-13-20(24-18-11-7-4-8-12-18)22(21,2)16-14-19(21)23-17-9-5-3-6-10-17/h3-14H,15-16H2,1-2H3