N-(1-azanyl-3-phenyl-propan-2-yl)-4-bromanyl-3-methoxy-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide

Systemtic Name: N-(1-azanyl-3-phenyl-propan-2-yl)-4-bromanyl-3-methoxy-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Openeye Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-bromo-3-methoxy-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide CAS Name: N-(1-amino-3-phenylpropan-2-yl)-4-bromo-3-methoxy-5-(2-methyl-3-pyrazolyl)-2-thiophenecarboxamide IUPAC Name: N-(1-amino-3-phenylpropan-2-yl)-4-bromo-3-methoxy-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Traditional Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-bromo-3-methoxy-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Formula: C19H21BrN4O2S MolecularWeight: 449.36464

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C2=C(C(=C(S2)C(=O)NC(CC3=CC=CC=C3)CN)OC)Br

Isomeric SMILES

CN1C(=CC=N1)C2=C(C(=C(S2)C(=O)NC(CC3=CC=CC=C3)CN)OC)Br

InChI

InChI=1S/C19H21BrN4O2S/c1-24-14(8-9-22-24)17-15(20)16(26-2)18(27-17)19(25)23-13(11-21)10-12-6-4-3-5-7-12/h3-9,13H,10-11,21H2,1-2H3,(H,23,25)