2-[(3Z)-2-oxidanylidene-3-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]indol-1-yl]ethanoic acid

Systemtic Name: 2-[(3Z)-2-oxidanylidene-3-[4-oxidanylidene-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]indol-1-yl]ethanoic acid Openeye Name: 2-[(3Z)-2-oxo-3-[4-oxo-2-(4-phenylpiperazin-1-yl)thiazol-5-ylidene]indolin-1-yl]acetic acid CAS Name: 2-[(3Z)-2-oxo-3-[4-oxo-2-(4-phenyl-1-piperazinyl)-5-thiazolylidene]-1-indolyl]acetic acid IUPAC Name: 2-[(3Z)-2-oxo-3-[4-oxo-2-(4-phenylpiperazin-1-yl)-1,3-thiazol-5-ylidene]indol-1-yl]acetic acid Traditional Name: 2-[(3Z)-2-keto-3-[4-keto-2-(4-phenylpiperazino)-2-thiazolin-5-ylidene]indolin-1-yl]acetic acid Formula: C23H20N4O4S MolecularWeight: 448.4943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC(=O)C(=C4C5=CC=CC=C5N(C4=O)CC(=O)O)S3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC(=O)/C(=C/4\C5=CC=CC=C5N(C4=O)CC(=O)O)/S3

InChI

InChI=1S/C23H20N4O4S/c28-18(29)14-27-17-9-5-4-8-16(17)19(22(27)31)20-21(30)24-23(32-20)26-12-10-25(11-13-26)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,28,29)/b20-19-