N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-[2-(3,4-dichlorophenyl)-5-pyridin-3-yl-pyrazol-3-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-5-[2-(3,4-dichlorophenyl)-5-pyridin-3-yl-pyrazol-3-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-5-[2-(3,4-dichlorophenyl)-5-(3-pyridyl)pyrazol-3-yl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-[2-(3,4-dichlorophenyl)-5-(3-pyridinyl)-3-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-5-[2-(3,4-dichlorophenyl)-5-pyridin-3-ylpyrazol-3-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-5-[2-(3,4-dichlorophenyl)-5-(3-pyridyl)pyrazol-3-yl]thiophene-2-carboxamide Formula: C28H21Cl2N5O2S MolecularWeight: 562.46964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)N)NC(=O)C2=CC=C(S2)C3=CC(=NN3C4=CC(=C(C=C4)Cl)Cl)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)NC(=O)C2=CC=C(S2)C3=CC(=NN3C4=CC(=C(C=C4)Cl)Cl)C5=CN=CC=C5

InChI

InChI=1S/C28H21Cl2N5O2S/c29-20-9-8-19(14-21(20)30)35-24(15-22(34-35)18-7-4-12-32-16-18)25-10-11-26(38-25)28(37)33-23(27(31)36)13-17-5-2-1-3-6-17/h1-12,14-16,23H,13H2,(H2,31,36)(H,33,37)/t23-/m0/s1