2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxy-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-methyl-2-oxo-chromen-7-yl)oxy-acetamide CAS Name: 2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-(4-methyl-2-oxochromen-7-yl)oxyacetamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2-(2-keto-4-methyl-chromen-7-yl)oxy-acetamide Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=NN=C(S3)SCC4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S2/c1-13-9-19(26)28-17-10-15(7-8-16(13)17)27-11-18(25)22-20-23-24-21(30-20)29-12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3,(H,22,23,25)