1,5-bis(butylsulfanyl)-3-phenyl-pentalene

Systemtic Name: 1,5-bis(butylsulfanyl)-3-phenyl-pentalene Openeye Name: 1,5-bis(butylsulfanyl)-3-phenyl-pentalene CAS Name: 1,5-bis(butylthio)-3-phenylpentalene IUPAC Name: 1,5-bis(butylsulfanyl)-3-phenylpentalene Traditional Name: 1,5-bis(butylthio)-3-phenyl-pentalene Formula: C22H26S2 MolecularWeight: 354.57184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C(C2=C1)SCCCC)C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=CC2=C(C=C(C2=C1)SCCCC)C3=CC=CC=C3

InChI

InChI=1S/C22H26S2/c1-3-5-12-23-18-14-20-19(17-10-8-7-9-11-17)16-22(21(20)15-18)24-13-6-4-2/h7-11,14-16H,3-6,12-13H2,1-2H3