ethyl 4-phenyl-2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]quinoline-3-carboxylate CAS Name: 4-phenyl-2-[[[(2Z)-2-(2-pyrrolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]quinoline-3-carboxylate Traditional Name: 4-phenyl-2-[[[(2Z)-2-pyrrol-2-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]quinoline-3-carboxylic acid ethyl ester Formula: C25H20N4O3S MolecularWeight: 456.5163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NNC(=C4C=CC=N4)O3)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1CSC3=NN/C(=C/4\C=CC=N4)/O3)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O3S/c1-2-31-24(30)22-20(15-33-25-29-28-23(32-25)19-13-8-14-26-19)27-18-12-7-6-11-17(18)21(22)16-9-4-3-5-10-16/h3-14,28H,2,15H2,1H3/b23-19-