4-methyl-3-[[(5E)-5-[(1-methylindol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoate

Systemtic Name: 4-methyl-3-[[(5E)-5-[(1-methylindol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoate Openeye Name: 4-methyl-3-[[(5E)-5-[(1-methylindol-3-yl)methylene]-4-oxo-thiazol-2-yl]amino]benzoate CAS Name: 4-methyl-3-[[(5E)-5-[(1-methyl-3-indolyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoate IUPAC Name: 4-methyl-3-[[(5E)-5-[(1-methylindol-3-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoate Traditional Name: 3-[[(5E)-4-keto-5-[(1-methylindol-3-yl)methylene]-2-thiazolin-2-yl]amino]-4-methyl-benzoate Formula: C21H16N3O3S- MolecularWeight: 390.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC2=NC(=O)C(=CC3=CN(C4=CC=CC=C43)C)S2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC2=NC(=O)/C(=C\C3=CN(C4=CC=CC=C43)C)/S2

InChI

InChI=1S/C21H17N3O3S/c1-12-7-8-13(20(26)27)9-16(12)22-21-23-19(25)18(28-21)10-14-11-24(2)17-6-4-3-5-15(14)17/h3-11H,1-2H3,(H,26,27)(H,22,23,25)/p-1/b18-10+