5-bromanyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]thiophene-3-carboxamide

Systemtic Name: 5-bromanyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]thiophene-3-carboxamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methyl-thiophene-3-carboxamide CAS Name: 5-bromo-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-3-thiophenecarboxamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methylthiophene-3-carboxamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methyl-thiophene-3-carboxamide Formula: C17H16BrN3OS MolecularWeight: 390.29744

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CSC(=C3)Br

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CSC(=C3)Br

InChI

InChI=1S/C17H16BrN3OS/c1-20(17(22)15-7-16(18)23-12-15)9-14-8-19-21(11-14)10-13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3