3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-[1]benzothiolo[3,2-c]pyridine hydrochloride

Systemtic Name: 3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-[1]benzothiolo[3,2-c]pyridine hydrochloride Openeye Name: 3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-benzothiopheno[3,2-c]pyridine hydrochloride CAS Name: 3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-[1]benzothiolo[3,2-c]pyridine hydrochloride IUPAC Name: 3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-[1]benzothiolo[3,2-c]pyridine hydrochloride Traditional Name: 3-methyl-2-phenethyl-4-phenyl-3,4-dihydro-1H-benzothiopheno[3,2-c]pyridine hydrochloride Formula: C26H26ClNS MolecularWeight: 420.00934

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(CN1CCC3=CC=CC=C3)C4=CC=CC=C4S2)C5=CC=CC=C5.Cl

Isomeric SMILES

CC1C(C2=C(CN1CCC3=CC=CC=C3)C4=CC=CC=C4S2)C5=CC=CC=C5.Cl

InChI

InChI=1S/C26H25NS.ClH/c1-19-25(21-12-6-3-7-13-21)26-23(22-14-8-9-15-24(22)28-26)18-27(19)17-16-20-10-4-2-5-11-20;/h2-15,19,25H,16-18H2,1H3;1H