5-methyl-1-(3-methylphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-(3-methylphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]pyrazole-4-carboxamide Openeye Name: 5-methyl-1-(m-tolyl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]pyrazole-4-carboxamide CAS Name: 5-methyl-1-(3-methylphenyl)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-1-(3-methylphenyl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]pyrazole-4-carboxamide Traditional Name: 5-methyl-1-(m-tolyl)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]pyrazole-4-carboxamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCC3=CC=C(S3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C21H24N4O3S2/c1-15-6-5-7-17(12-15)25-16(2)19(14-23-25)21(26)22-13-18-8-9-20(29-18)30(27,28)24-10-3-4-11-24/h5-9,12,14H,3-4,10-11,13H2,1-2H3,(H,22,26)