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

Systemtic Name: N-(1-azanyl-3-phenyl-propan-2-yl)-4-(furan-3-yl)-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Openeye Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-(3-furyl)-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide CAS Name: N-(1-amino-3-phenylpropan-2-yl)-4-(3-furanyl)-5-(2-methyl-3-pyrazolyl)-2-thiophenecarboxamide IUPAC Name: N-(1-amino-3-phenylpropan-2-yl)-4-(furan-3-yl)-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Traditional Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-(3-furyl)-5-(2-methylpyrazol-3-yl)thiophene-2-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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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)C4=COC=C4

Isomeric SMILES

CN1C(=CC=N1)C2=C(C=C(S2)C(=O)NC(CC3=CC=CC=C3)CN)C4=COC=C4

InChI

InChI=1S/C22H22N4O2S/c1-26-19(7-9-24-26)21-18(16-8-10-28-14-16)12-20(29-21)22(27)25-17(13-23)11-15-5-3-2-4-6-15/h2-10,12,14,17H,11,13,23H2,1H3,(H,25,27)