ethyl (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]pyrrole-3-carboxylate

Systemtic Name: ethyl (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]pyrrole-3-carboxylate Openeye Name: ethyl (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]pyrrole-3-carboxylate CAS Name: (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]pyrrole-3-carboxylate Traditional Name: (5Z)-2,4-dimethyl-5-[[(3-phenyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]pyrrole-3-carboxylic acid ethyl ester Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CNN2C(=NNC2=S)C3=CC=CC=C3)N=C1C)C

Isomeric SMILES

CCOC(=O)C1=C(/C(=C/NN2C(=NNC2=S)C3=CC=CC=C3)/N=C1C)C

InChI

InChI=1S/C18H19N5O2S/c1-4-25-17(24)15-11(2)14(20-12(15)3)10-19-23-16(21-22-18(23)26)13-8-6-5-7-9-13/h5-10,19H,4H2,1-3H3,(H,22,26)/b14-10-