3-[[5-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]-4-methyl-benzoic acid

Systemtic Name: 3-[[5-(5-bromanyl-2-oxidanylidene-1H-indol-3-ylidene)-4-oxidanylidene-1,3-thiazol-2-yl]amino]-4-methyl-benzoic acid Openeye Name: 3-[[5-(5-bromo-2-oxo-indolin-3-ylidene)-4-oxo-thiazol-2-yl]amino]-4-methyl-benzoic acid CAS Name: 3-[[5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-oxo-2-thiazolyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[5-(5-bromo-2-oxo-1H-indol-3-ylidene)-4-oxo-1,3-thiazol-2-yl]amino]-4-methylbenzoic acid Traditional Name: 3-[[5-(5-bromo-2-keto-indolin-3-ylidene)-4-keto-2-thiazolin-2-yl]amino]-4-methyl-benzoic acid Formula: C19H12BrN3O4S MolecularWeight: 458.28528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=O)C(=C3C4=C(C=CC(=C4)Br)NC3=O)S2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=O)C(=C3C4=C(C=CC(=C4)Br)NC3=O)S2

InChI

InChI=1S/C19H12BrN3O4S/c1-8-2-3-9(18(26)27)6-13(8)22-19-23-17(25)15(28-19)14-11-7-10(20)4-5-12(11)21-16(14)24/h2-7H,1H3,(H,21,24)(H,26,27)(H,22,23,25)