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

Systemtic Name: 7-bromanyl-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one Openeye Name: 7-bromo-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one CAS Name: 7-bromo-4-[[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]chromen-2-one Traditional Name: 7-bromo-4-[[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]coumarin Formula: C20H12BrN3O3S MolecularWeight: 454.29658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3NN=C(O3)SCC4=CC(=O)OC5=C4C=CC(=C5)Br)C=N2

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\3/NN=C(O3)SCC4=CC(=O)OC5=C4C=CC(=C5)Br)/C=N2

InChI

InChI=1S/C20H12BrN3O3S/c21-12-5-6-13-11(7-18(25)26-17(13)8-12)10-28-20-24-23-19(27-20)15-9-22-16-4-2-1-3-14(15)16/h1-9,23H,10H2/b19-15-