(3aR,6aR)-2,5-bis[(4-chlorophenyl)sulfanyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene

Systemtic Name: (3aR,6aR)-2,5-bis[(4-chlorophenyl)sulfanyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene Openeye Name: (3aR,6aR)-2,5-bis[(4-chlorophenyl)sulfanyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene CAS Name: (3aR,6aR)-2,5-bis[(4-chlorophenyl)thio]-3a-ethyl-6a-methyl-1,4-dihydropentalene IUPAC Name: (3aR,6aR)-2,5-bis[(4-chlorophenyl)sulfanyl]-3a-ethyl-6a-methyl-1,4-dihydropentalene Traditional Name: (3aR,6aR)-2,5-bis[(4-chlorophenyl)thio]-3a-ethyl-6a-methyl-1,4-dihydropentalene Formula: C23H22Cl2S2 MolecularWeight: 433.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(=CC1(CC(=C2)SC3=CC=C(C=C3)Cl)C)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC[C@]12CC(=C[C@]1(CC(=C2)SC3=CC=C(C=C3)Cl)C)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22Cl2S2/c1-3-23-14-20(26-18-8-4-16(24)5-9-18)12-22(23,2)13-21(15-23)27-19-10-6-17(25)7-11-19/h4-12,15H,3,13-14H2,1-2H3/t22-,23+/m0/s1