[(1S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(2,3-dimethyl-1H-indole-5-carbonyl)amino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C19H24N3OS+ MolecularWeight: 342.47836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC(C3=CSC=C3)[NH+](C)C)C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)NC[C@H](C3=CSC=C3)[NH+](C)C)C

InChI

InChI=1S/C19H23N3OS/c1-12-13(2)21-17-6-5-14(9-16(12)17)19(23)20-10-18(22(3)4)15-7-8-24-11-15/h5-9,11,18,21H,10H2,1-4H3,(H,20,23)/p+1/t18-/m1/s1