N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-oxidanylidene-isothiochromene-3-carboxamide

Systemtic Name: N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-oxidanylidene-isothiochromene-3-carboxamide Openeye Name: N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-oxo-isothiochromene-3-carboxamide CAS Name: N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-1-oxoisothiochromene-3-carboxamide Traditional Name: N-[5-(3-fluorobenzyl)-1,3,4-thiadiazol-2-yl]-1-keto-isothiochromene-3-carboxamide Formula: C19H12FN3O2S2 MolecularWeight: 397.445883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NC3=NN=C(S3)CC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NC3=NN=C(S3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C19H12FN3O2S2/c20-13-6-3-4-11(8-13)9-16-22-23-19(27-16)21-17(24)15-10-12-5-1-2-7-14(12)18(25)26-15/h1-8,10H,9H2,(H,21,23,24)