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

Systemtic Name: 4-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Openeye Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]benzamide CAS Name: 4-(4-chloro-3,5-dimethyl-1-pyrazolyl)-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]benzamide IUPAC Name: 4-(4-chloro-3,5-dimethylpyrazol-1-yl)-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]benzamide Traditional Name: 4-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]benzamide Formula: C21H23ClN4O3S2 MolecularWeight: 479.01532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN4O3S2/c1-14-20(22)15(2)26(24-14)17-7-5-16(6-8-17)21(27)23-13-18-9-10-19(30-18)31(28,29)25-11-3-4-12-25/h5-10H,3-4,11-13H2,1-2H3,(H,23,27)