2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]thiophen-2-yl]but-3-yn-2-ol

Systemtic Name: 2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]thiophen-2-yl]but-3-yn-2-ol Openeye Name: 2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]-2-thienyl]but-3-yn-2-ol CAS Name: 2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenyl-4-pyrazolyl)ethyl]amino]methyl]-2-thiophenyl]-3-butyn-2-ol IUPAC Name: 2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenylpyrazol-4-yl)ethyl]amino]methyl]thiophen-2-yl]but-3-yn-2-ol Traditional Name: 2-methyl-4-[5-[[[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amino]methyl]-2-thienyl]but-3-yn-2-ol Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=CC=C(S3)C#CC(C)(C)O

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)NCC3=CC=C(S3)C#CC(C)(C)O

InChI

InChI=1S/C22H25N3OS/c1-16(21-15-24-25(17(21)2)18-8-6-5-7-9-18)23-14-20-11-10-19(27-20)12-13-22(3,4)26/h5-11,15-16,23,26H,14H2,1-4H3/t16-/m0/s1