2-phenyl-5-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-3,4-dihydropyrazole-3-carboxamide

Systemtic Name: 2-phenyl-5-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-3,4-dihydropyrazole-3-carboxamide Openeye Name: 2-phenyl-5-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-3,4-dihydropyrazole-3-carboxamide CAS Name: 5-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]-2-phenyl-3,4-dihydropyrazole-3-carboxamide IUPAC Name: 2-phenyl-5-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)-3,4-dihydropyrazole-3-carboxamide Traditional Name: 2-phenyl-5-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-2-pyrazoline-3-carboxamide Formula: C19H21N5O4S2 MolecularWeight: 447.53114

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C2=NN(C(C2)C(=O)N)C3=CC=CC=C3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H21N5O4S2/c20-18(25)16-13-15(21-24(16)14-5-2-1-3-6-14)19(26)22-8-10-23(11-9-22)30(27,28)17-7-4-12-29-17/h1-7,12,16H,8-11,13H2,(H2,20,25)