dimethyl 5-azanyl-3-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanylmethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H16N4O5S2 MolecularWeight: 444.48414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1CSC2=NNC(=C3C=NC4=CC=CC=C43)O2)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1CSC2=NN/C(=C/3\C=NC4=CC=CC=C43)/O2)C(=O)OC)N

InChI

InChI=1S/C19H16N4O5S2/c1-26-17(24)13-11(14(18(25)27-2)30-15(13)20)8-29-19-23-22-16(28-19)10-7-21-12-6-4-3-5-9(10)12/h3-7,22H,8,20H2,1-2H3/b16-10-