3-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide

Systemtic Name: 3-(4-bromanyl-5-methyl-pyrazol-1-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Openeye Name: 3-(4-bromo-5-methyl-pyrazol-1-yl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: 3-(4-bromo-5-methyl-1-pyrazolyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide IUPAC Name: 3-(4-bromo-5-methylpyrazol-1-yl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 3-(4-bromo-5-methyl-pyrazol-1-yl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C16H17BrN4OS MolecularWeight: 393.30138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

Isomeric SMILES

CC1=C(C=NN1CCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br

InChI

InChI=1S/C16H17BrN4OS/c1-10-13(17)9-19-21(10)7-6-15(22)20-16-12(8-18)11-4-2-3-5-14(11)23-16/h9H,2-7H2,1H3,(H,20,22)