4-[[(5Z)-5-[(1-methylindol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-5-[(1-methylindol-3-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[(5Z)-5-[(1-methylindol-3-yl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[(5Z)-5-[(1-methyl-3-indolyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[(5Z)-5-[(1-methylindol-3-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[(5Z)-4-keto-5-[(1-methylindol-3-yl)methylene]-2-thiazolin-2-yl]amino]benzoic acid Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=C3C(=O)N=C(S3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=C\3/C(=O)N=C(S3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C20H15N3O3S/c1-23-11-13(15-4-2-3-5-16(15)23)10-17-18(24)22-20(27-17)21-14-8-6-12(7-9-14)19(25)26/h2-11H,1H3,(H,25,26)(H,21,22,24)/b17-10-