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

Systemtic Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-N-[(5-morpholinosulfonyl-2-thienyl)methyl]propanamide CAS Name: 3-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]-N-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]propanamide IUPAC Name: 3-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)-N-[(5-morpholinosulfonyl-2-thienyl)methyl]propionamide Formula: C21H32N4O4S2 MolecularWeight: 468.63318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CCC(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H32N4O4S2/c1-15(2)14-25-17(4)19(16(3)23-25)6-7-20(26)22-13-18-5-8-21(30-18)31(27,28)24-9-11-29-12-10-24/h5,8,15H,6-7,9-14H2,1-4H3,(H,22,26)