[2-[(1-ethanoyl-2,3-dihydroindol-5-yl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium

Systemtic Name: [2-[(1-ethanoyl-2,3-dihydroindol-5-yl)amino]-2-oxidanylidene-ethyl]-[(5-methylthiophen-2-yl)methyl]-phenethyl-azanium Openeye Name: [2-[(1-acetylindolin-5-yl)amino]-2-oxo-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium CAS Name: [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl]-[(5-methyl-2-thiophenyl)methyl]-phenethylammonium IUPAC Name: [2-[(1-acetyl-2,3-dihydroindol-5-yl)amino]-2-oxoethyl]-[(5-methylthiophen-2-yl)methyl]-phenethylazanium Traditional Name: [2-[(1-acetylindolin-5-yl)amino]-2-keto-ethyl]-[(5-methyl-2-thienyl)methyl]-phenethyl-ammonium Formula: C26H30N3O2S+ MolecularWeight: 448.6003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)N(CC4)C(=O)C

Isomeric SMILES

CC1=CC=C(S1)C[NH+](CCC2=CC=CC=C2)CC(=O)NC3=CC4=C(C=C3)N(CC4)C(=O)C

InChI

InChI=1S/C26H29N3O2S/c1-19-8-10-24(32-19)17-28(14-12-21-6-4-3-5-7-21)18-26(31)27-23-9-11-25-22(16-23)13-15-29(25)20(2)30/h3-11,16H,12-15,17-18H2,1-2H3,(H,27,31)/p+1