N-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]thiophene-2-carboxamide; thiophene

Systemtic Name: N-[3-(4-bromanyl-1-methyl-pyrazol-3-yl)phenyl]thiophene-2-carboxamide; thiophene Openeye Name: N-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]thiophene-2-carboxamide; thiophene CAS Name: N-[3-(4-bromo-1-methyl-3-pyrazolyl)phenyl]-2-thiophenecarboxamide; thiophene IUPAC Name: N-[3-(4-bromo-1-methylpyrazol-3-yl)phenyl]thiophene-2-carboxamide; thiophene Traditional Name: N-[3-(4-bromo-1-methyl-pyrazol-3-yl)phenyl]thiophene-2-carboxamide; thiophene Formula: C19H16BrN3OS2 MolecularWeight: 446.38384

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)Br.C1=CSC=C1

Isomeric SMILES

CN1C=C(C(=N1)C2=CC(=CC=C2)NC(=O)C3=CC=CS3)Br.C1=CSC=C1

InChI

InChI=1S/C15H12BrN3OS.C4H4S/c1-19-9-12(16)14(18-19)10-4-2-5-11(8-10)17-15(20)13-6-3-7-21-13;1-2-4-5-3-1/h2-9H,1H3,(H,17,20);1-4H