2-[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]amino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[(2R)-2-(4-dimethylaminophenyl)-2-(1H-indol-3-yl)ethyl]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C23H32N5S+ MolecularWeight: 410.59868

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NCC(C1=CC=C(C=C1)N(C)C)C2=CNC3=CC=CC=C32

Isomeric SMILES

C[NH+](C)CCNC(=S)NC[C@H](C1=CC=C(C=C1)N(C)C)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C23H31N5S/c1-27(2)14-13-24-23(29)26-15-20(17-9-11-18(12-10-17)28(3)4)21-16-25-22-8-6-5-7-19(21)22/h5-12,16,20,25H,13-15H2,1-4H3,(H2,24,26,29)/p+1/t20-/m1/s1