[2,6-diethyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] propanoate

Systemtic Name: [2,6-diethyl-4-oxidanylidene-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] propanoate Openeye Name: [2,6-diethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] propanoate CAS Name: propanoic acid [2,6-diethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)-1-benzopyran-7-yl] ester IUPAC Name: [2,6-diethyl-4-oxo-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] propanoate Traditional Name: propionic acid [2,6-diethyl-4-keto-3-(5-phenyl-1,3,4-thiadiazol-2-yl)chromen-7-yl] ester Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N2O4S/c1-4-14-12-16-19(13-18(14)30-20(27)6-3)29-17(5-2)21(22(16)28)24-26-25-23(31-24)15-10-8-7-9-11-15/h7-13H,4-6H2,1-3H3