N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[(4-oxidanylidene-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[[4-oxo-6-(2-thienyl)-1H-pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[(4-oxo-6-thiophen-2-yl-1H-pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[[4-keto-6-(2-thienyl)-1H-pyrimidin-2-yl]thio]acetamide Formula: C21H19N5O3S2 MolecularWeight: 453.53726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NC(=O)C=C(N3)C4=CC=CS4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NC(=O)C=C(N3)C4=CC=CS4

InChI

InChI=1S/C21H19N5O3S2/c1-13-19(20(29)26(25(13)2)14-7-4-3-5-8-14)23-18(28)12-31-21-22-15(11-17(27)24-21)16-9-6-10-30-16/h3-11H,12H2,1-2H3,(H,23,28)(H,22,24,27)