3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide

Systemtic Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]propanamide CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]propionamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H28N4O3S2/c1-17-21(18(2)27(25-17)19-8-4-3-5-9-19)11-12-22(28)24-16-20-10-13-23(31-20)32(29,30)26-14-6-7-15-26/h3-5,8-10,13H,6-7,11-12,14-16H2,1-2H3,(H,24,28)