dimethyl-[(1S)-2-(6,7,8,9-tetrahydro-5H-carbazol-3-ylcarbonylamino)-1-thiophen-3-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-(6,7,8,9-tetrahydro-5H-carbazol-3-ylcarbonylamino)-1-thiophen-3-yl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)-1-(3-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo(6,7,8,9-tetrahydro-5H-carbazol-3-yl)methyl]amino]-1-(3-thiophenyl)ethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)-1-thiophen-3-ylethyl]azanium Traditional Name: dimethyl-[(1S)-2-(6,7,8,9-tetrahydro-5H-carbazole-3-carbonylamino)-1-(3-thienyl)ethyl]ammonium Formula: C21H26N3OS+ MolecularWeight: 368.51564

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC2=C(C=C1)NC3=C2CCCC3)C4=CSC=C4

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC2=C(C=C1)NC3=C2CCCC3)C4=CSC=C4

InChI

InChI=1S/C21H25N3OS/c1-24(2)20(15-9-10-26-13-15)12-22-21(25)14-7-8-19-17(11-14)16-5-3-4-6-18(16)23-19/h7-11,13,20,23H,3-6,12H2,1-2H3,(H,22,25)/p+1/t20-/m1/s1