3-(3-methylphenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3-methylphenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-3-(m-tolyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(3-methylphenyl)-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(3-methylphenyl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-3-(m-tolyl)-1-phenyl-pyrazole-4-carboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)NCC(C3=CC=CS3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)NC[C@@H](C3=CC=CS3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O2S/c1-20-7-5-8-21(17-20)26-23(19-31(29-26)22-9-3-2-4-10-22)27(32)28-18-24(25-11-6-16-34-25)30-12-14-33-15-13-30/h2-11,16-17,19,24H,12-15,18H2,1H3,(H,28,32)/t24-/m0/s1