2-[5-[[5-azanylidene-3-oxidanylidene-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]furan-2-yl]benzoic acid

Systemtic Name: 2-[5-[[5-azanylidene-3-oxidanylidene-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]furan-2-yl]benzoic acid Openeye Name: 2-[5-[(5-imino-3-oxo-4-thiazol-2-yl-tetrahydrothiophen-2-ylidene)methyl]-2-furyl]benzoic acid CAS Name: 2-[5-[[5-imino-3-oxo-4-(2-thiazolyl)-2-thiolanylidene]methyl]-2-furanyl]benzoic acid IUPAC Name: 2-[5-[[5-imino-3-oxo-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]furan-2-yl]benzoic acid Traditional Name: 2-[5-[(5-imino-3-keto-4-thiazol-2-yl-tetrahydrothiophen-2-ylidene)methyl]-2-furyl]benzoic acid Formula: C19H12N2O4S2 MolecularWeight: 396.43958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(O2)C=C3C(=O)C(C(=N)S3)C4=NC=CS4)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(O2)C=C3C(=O)C(C(=N)S3)C4=NC=CS4)C(=O)O

InChI

InChI=1S/C19H12N2O4S2/c20-17-15(18-21-7-8-26-18)16(22)14(27-17)9-10-5-6-13(25-10)11-3-1-2-4-12(11)19(23)24/h1-9,15,20H,(H,23,24)