5,7-dimethyl-4-oxidanylidene-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]chromene-2-carboxamide

Systemtic Name: 5,7-dimethyl-4-oxidanylidene-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]chromene-2-carboxamide Openeye Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-5,7-dimethyl-4-oxo-chromene-2-carboxamide CAS Name: 5,7-dimethyl-4-oxo-N-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]-1-benzopyran-2-carboxamide IUPAC Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-5,7-dimethyl-4-oxochromene-2-carboxamide Traditional Name: N-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]-4-keto-5,7-dimethyl-chromene-2-carboxamide Formula: C21H17N3O3S2 MolecularWeight: 423.50798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=CC2=O)C(=O)NC3=NC(=NS3)SCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OC(=CC2=O)C(=O)NC3=NC(=NS3)SCC4=CC=CC=C4)C

InChI

InChI=1S/C21H17N3O3S2/c1-12-8-13(2)18-15(25)10-17(27-16(18)9-12)19(26)22-20-23-21(24-29-20)28-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,22,23,24,26)