2-dimethylaminoethyl (5Z)-2,4-dimethyl-5-[(3-oxidanylidene-5-thiophen-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: 2-dimethylaminoethyl (5Z)-2,4-dimethyl-5-[(3-oxidanylidene-5-thiophen-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: 2-dimethylaminoethyl (5Z)-2,4-dimethyl-5-[[3-oxo-5-(2-thienyl)-1,2-dihydropyrazol-4-yl]methylene]pyrrole-3-carboxylate CAS Name: (5Z)-2,4-dimethyl-5-[(3-oxo-5-thiophen-2-yl-1,2-dihydropyrazol-4-yl)methylidene]-3-pyrrolecarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl (5Z)-2,4-dimethyl-5-[(3-oxo-5-thiophen-2-yl-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (5Z)-5-[[3-keto-5-(2-thienyl)-3-pyrazolin-4-yl]methylene]-2,4-dimethyl-pyrrole-3-carboxylic acid 2-dimethylaminoethyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC1=CC2=C(NNC2=O)C3=CC=CS3)C)C(=O)OCCN(C)C

Isomeric SMILES

CC\1=C(C(=N/C1=C\C2=C(NNC2=O)C3=CC=CS3)C)C(=O)OCCN(C)C

InChI

InChI=1S/C19H22N4O3S/c1-11-14(20-12(2)16(11)19(25)26-8-7-23(3)4)10-13-17(21-22-18(13)24)15-6-5-9-27-15/h5-6,9-10H,7-8H2,1-4H3,(H2,21,22,24)/b14-10-