(5-chloranylthiophen-2-yl)methyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-prop-2-enylammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[(5-chloro-2-thienyl)methyl]-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]ammonium Formula: C20H23ClN3OS+ MolecularWeight: 388.93412

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Cl)CC(=O)NCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C20H22ClN3OS/c1-2-11-24(13-16-7-8-19(21)26-16)14-20(25)22-10-9-15-12-23-18-6-4-3-5-17(15)18/h2-8,12,23H,1,9-11,13-14H2,(H,22,25)/p+1