6-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]coumarin Formula: C22H17N3O4S MolecularWeight: 419.45308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NNC(=C4C=NC5=CC=CC=C54)O3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NN/C(=C/4\C=NC5=CC=CC=C54)/O3)O

InChI

InChI=1S/C22H17N3O4S/c1-2-12-7-15-13(8-20(27)28-19(15)9-18(12)26)11-30-22-25-24-21(29-22)16-10-23-17-6-4-3-5-14(16)17/h3-10,24,26H,2,11H2,1H3/b21-16-