ethyl (E)-2-cyano-3-[[2-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]phenyl]amino]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[[2-[(1-methyl-2-oxidanylidene-3H-indol-5-yl)sulfonylamino]phenyl]amino]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-[(1-methyl-2-oxo-indolin-5-yl)sulfonylamino]anilino]prop-2-enoate CAS Name: (E)-2-cyano-3-[2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]anilino]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-[(1-methyl-2-oxo-3H-indol-5-yl)sulfonylamino]anilino]prop-2-enoate Traditional Name: (E)-2-cyano-3-[2-[(2-keto-1-methyl-indolin-5-yl)sulfonylamino]anilino]acrylic acid ethyl ester Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC=C1NS(=O)(=O)C2=CC3=C(C=C2)N(C(=O)C3)C)/C#N

InChI

InChI=1S/C21H20N4O5S/c1-3-30-21(27)15(12-22)13-23-17-6-4-5-7-18(17)24-31(28,29)16-8-9-19-14(10-16)11-20(26)25(19)2/h4-10,13,23-24H,3,11H2,1-2H3/b15-13+