3-[5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3,4-thiadiazol-2-yl]-8-ethoxy-chromen-2-one

Systemtic Name: 3-[5-[(3-chloranyl-4-fluoranyl-phenyl)amino]-1,3,4-thiadiazol-2-yl]-8-ethoxy-chromen-2-one Openeye Name: 3-[5-(3-chloro-4-fluoro-anilino)-1,3,4-thiadiazol-2-yl]-8-ethoxy-chromen-2-one CAS Name: 3-[5-(3-chloro-4-fluoroanilino)-1,3,4-thiadiazol-2-yl]-8-ethoxy-1-benzopyran-2-one IUPAC Name: 3-[5-(3-chloro-4-fluoroanilino)-1,3,4-thiadiazol-2-yl]-8-ethoxychromen-2-one Traditional Name: 3-[5-(3-chloro-4-fluoro-anilino)-1,3,4-thiadiazol-2-yl]-8-ethoxy-coumarin Formula: C19H13ClFN3O3S MolecularWeight: 417.841223

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NN=C(S3)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=O)C(=C2)C3=NN=C(S3)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C19H13ClFN3O3S/c1-2-26-15-5-3-4-10-8-12(18(25)27-16(10)15)17-23-24-19(28-17)22-11-6-7-14(21)13(20)9-11/h3-9H,2H2,1H3,(H,22,24)