methyl 4-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-5-(2-thiophen-2-ylethanoylamino)-1H-indol-4-yl]benzoate

Systemtic Name: methyl 4-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxidanylidene-5-(2-thiophen-2-ylethanoylamino)-1H-indol-4-yl]benzoate Openeye Name: methyl 4-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-2-oxo-5-[[2-(2-thienyl)acetyl]amino]indolin-4-yl]benzoate CAS Name: 4-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-5-[(1-oxo-2-thiophen-2-ylethyl)amino]-1H-indol-4-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3Z)-3-[(3-methoxy-1H-pyrrol-2-yl)methylidene]-2-oxo-5-[(2-thiophen-2-ylacetyl)amino]-1H-indol-4-yl]benzoate Traditional Name: 4-[(3Z)-2-keto-3-[(3-methoxy-1H-pyrrol-2-yl)methylene]-5-[[2-(2-thienyl)acetyl]amino]indolin-4-yl]benzoic acid methyl ester Formula: C28H23N3O5S MolecularWeight: 513.56432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(NC=C1)C=C2C3=C(C=CC(=C3C4=CC=C(C=C4)C(=O)OC)NC(=O)CC5=CC=CS5)NC2=O

Isomeric SMILES

COC1=C(NC=C1)/C=C\2/C3=C(C=CC(=C3C4=CC=C(C=C4)C(=O)OC)NC(=O)CC5=CC=CS5)NC2=O

InChI

InChI=1S/C28H23N3O5S/c1-35-23-11-12-29-22(23)15-19-26-21(31-27(19)33)10-9-20(30-24(32)14-18-4-3-13-37-18)25(26)16-5-7-17(8-6-16)28(34)36-2/h3-13,15,29H,14H2,1-2H3,(H,30,32)(H,31,33)/b19-15-