1-heptyl-1-(4-methylphenyl)sulfanyl-3,4-dihydro-2H-isoquinoline

Systemtic Name: 1-heptyl-1-(4-methylphenyl)sulfanyl-3,4-dihydro-2H-isoquinoline Openeye Name: 1-heptyl-1-(p-tolylsulfanyl)-3,4-dihydro-2H-isoquinoline CAS Name: 1-heptyl-1-[(4-methylphenyl)thio]-3,4-dihydro-2H-isoquinoline IUPAC Name: 1-heptyl-1-(4-methylphenyl)sulfanyl-3,4-dihydro-2H-isoquinoline Traditional Name: 1-heptyl-1-(p-tolylthio)-3,4-dihydro-2H-isoquinoline Formula: C23H31NS MolecularWeight: 353.56394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C2=CC=CC=C2CCN1)SC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC1(C2=CC=CC=C2CCN1)SC3=CC=C(C=C3)C

InChI

InChI=1S/C23H31NS/c1-3-4-5-6-9-17-23(25-21-14-12-19(2)13-15-21)22-11-8-7-10-20(22)16-18-24-23/h7-8,10-15,24H,3-6,9,16-18H2,1-2H3