2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)ethanamide Openeye Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide CAS Name: 2-[[4-(4-bromophenyl)-2-pyrimidinyl]thio]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide IUPAC Name: 2-[4-(4-bromophenyl)pyrimidin-2-yl]sulfanyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide Traditional Name: 2-[[4-(4-bromophenyl)pyrimidin-2-yl]thio]-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide Formula: C17H16BrN5OS MolecularWeight: 418.31084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)CSC2=NC=CC(=N2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H16BrN5OS/c1-10-16(11(2)23-22-10)21-15(24)9-25-17-19-8-7-14(20-17)12-3-5-13(18)6-4-12/h3-8H,9H2,1-2H3,(H,21,24)(H,22,23)