2-bromanyl-N-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-5-methoxy-benzamide

Systemtic Name: 2-bromanyl-N-[2-(5,6-dimethyl-4-oxidanylidene-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]-5-methoxy-benzamide Openeye Name: 2-bromo-N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-5-methoxy-benzamide CAS Name: 2-bromo-N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-5-methoxybenzamide IUPAC Name: 2-bromo-N-[2-(5,6-dimethyl-4-oxo-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]-5-methoxybenzamide Traditional Name: 2-bromo-N-[2-(4-keto-5,6-dimethyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]-5-methoxy-benzamide Formula: C21H18BrN5O3S MolecularWeight: 500.36832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=C(C=CC(=C4)OC)Br)C

Isomeric SMILES

CC1=C(NC(=NC1=O)N2C(=CC(=N2)C3=CC=CS3)NC(=O)C4=C(C=CC(=C4)OC)Br)C

InChI

InChI=1S/C21H18BrN5O3S/c1-11-12(2)23-21(25-19(11)28)27-18(10-16(26-27)17-5-4-8-31-17)24-20(29)14-9-13(30-3)6-7-15(14)22/h4-10H,1-3H3,(H,24,29)(H,23,25,28)