[6-ethyl-2-methyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] ethanoate

Systemtic Name: [6-ethyl-2-methyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] ethanoate Openeye Name: [6-ethyl-2-methyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] acetate CAS Name: acetic acid [6-ethyl-2-methyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-2-methyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] acetate Traditional Name: acetic acid [6-ethyl-4-keto-2-methyl-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] ester Formula: C22H18N2O4S MolecularWeight: 406.45432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=NN=C(S3)C4=CC=CC=C4)OC(=O)C

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=NN=C(S3)C4=CC=CC=C4)OC(=O)C

InChI

InChI=1S/C22H18N2O4S/c1-4-14-10-16-18(11-17(14)28-13(3)25)27-12(2)19(20(16)26)22-24-23-21(29-22)15-8-6-5-7-9-15/h5-11H,4H2,1-3H3