tert-butyl 2-[4-[[1-methyl-6-(C-methylsulfanylcarbonimidoyl)indol-2-yl]carbonylamino]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[[1-methyl-6-(C-methylsulfanylcarbonimidoyl)indol-2-yl]carbonylamino]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[[1-methyl-6-(methylsulfanylcarbonimidoyl)indole-2-carbonyl]amino]phenoxy]acetate CAS Name: 2-[4-[[[6-[imino-(methylthio)methyl]-1-methyl-2-indolyl]-oxomethyl]amino]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[[1-methyl-6-(C-methylsulfanylcarbonimidoyl)indole-2-carbonyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[1-methyl-6-[(methylthio)carbonimidoyl]indole-2-carbonyl]amino]phenoxy]acetic acid tert-butyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC3=C(N2C)C=C(C=C3)C(=N)SC

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC3=C(N2C)C=C(C=C3)C(=N)SC

InChI

InChI=1S/C24H27N3O4S/c1-24(2,3)31-21(28)14-30-18-10-8-17(9-11-18)26-23(29)20-12-15-6-7-16(22(25)32-5)13-19(15)27(20)4/h6-13,25H,14H2,1-5H3,(H,26,29)