ethyl 6-[[5-(C-methylsulfanylcarbonimidoyl)-1H-indol-2-yl]carbonylamino]hexanoate

Systemtic Name: ethyl 6-[[5-(C-methylsulfanylcarbonimidoyl)-1H-indol-2-yl]carbonylamino]hexanoate Openeye Name: ethyl 6-[[5-(methylsulfanylcarbonimidoyl)-1H-indole-2-carbonyl]amino]hexanoate CAS Name: 6-[[[5-[imino-(methylthio)methyl]-1H-indol-2-yl]-oxomethyl]amino]hexanoic acid ethyl ester IUPAC Name: ethyl 6-[[5-(C-methylsulfanylcarbonimidoyl)-1H-indole-2-carbonyl]amino]hexanoate Traditional Name: 6-[[5-[(methylthio)carbonimidoyl]-1H-indole-2-carbonyl]amino]hexanoic acid ethyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)SC

Isomeric SMILES

CCOC(=O)CCCCCNC(=O)C1=CC2=C(N1)C=CC(=C2)C(=N)SC

InChI

InChI=1S/C19H25N3O3S/c1-3-25-17(23)7-5-4-6-10-21-19(24)16-12-14-11-13(18(20)26-2)8-9-15(14)22-16/h8-9,11-12,20,22H,3-7,10H2,1-2H3,(H,21,24)