[(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-(2-phenylsulfanylethyl)azanium

Systemtic Name: [(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-(2-phenylsulfanylethyl)azanium Openeye Name: [(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-(2-phenylsulfanylethyl)ammonium CAS Name: [(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-[2-(phenylthio)ethyl]ammonium IUPAC Name: [(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-(2-phenylsulfanylethyl)azanium Traditional Name: [(1R)-6-methyl-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-[2-(phenylthio)ethyl]ammonium Formula: C21H25N2S+ MolecularWeight: 337.5016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC3=C2CCCC3[NH2+]CCSC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC3=C2CCC[C@H]3[NH2+]CCSC4=CC=CC=C4

InChI

InChI=1S/C21H24N2S/c1-15-10-11-19-18(14-15)17-8-5-9-20(21(17)23-19)22-12-13-24-16-6-3-2-4-7-16/h2-4,6-7,10-11,14,20,22-23H,5,8-9,12-13H2,1H3/p+1/t20-/m1/s1