methyl 1-[[4-[(Z)-quinolin-4-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate

Systemtic Name: methyl 1-[[4-[(Z)-quinolin-4-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate Openeye Name: methyl 1-[[4-[(Z)-4-quinolylmethyleneamino]-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate CAS Name: 1-[[[4-[(Z)-4-quinolinylmethylideneamino]-1,2,4-triazol-3-yl]thio]methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-[(Z)-quinolin-4-ylmethylideneamino]-1,2,4-triazol-3-yl]sulfanylmethyl]pyrazole-3-carboxylate Traditional Name: 1-[[[4-[(Z)-4-quinolylmethyleneamino]-1,2,4-triazol-3-yl]thio]methyl]pyrazole-3-carboxylic acid methyl ester Formula: C18H15N7O2S MolecularWeight: 393.4224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN(C=C1)CSC2=NN=CN2N=CC3=CC=NC4=CC=CC=C34

Isomeric SMILES

COC(=O)C1=NN(C=C1)CSC2=NN=CN2/N=C\C3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C18H15N7O2S/c1-27-17(26)16-7-9-24(23-16)12-28-18-22-20-11-25(18)21-10-13-6-8-19-15-5-3-2-4-14(13)15/h2-11H,12H2,1H3/b21-10-