2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepine

Systemtic Name: 2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepine Openeye Name: 2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepine CAS Name: 2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepin IUPAC Name: 2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepine Traditional Name: 2-methyl-3-phenethyl-6,7-dihydro-5H-1,4-dithiepin Formula: C14H18S2 MolecularWeight: 250.42272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SCCCS1)CCC2=CC=CC=C2

Isomeric SMILES

CC1=C(SCCCS1)CCC2=CC=CC=C2

InChI

InChI=1S/C14H18S2/c1-12-14(16-11-5-10-15-12)9-8-13-6-3-2-4-7-13/h2-4,6-7H,5,8-11H2,1H3