2-methyl-4-nitro-5-propyl-N-[4-(pyrrolidin-1-ylsulfonylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-methyl-4-nitro-5-propyl-N-[4-(pyrrolidin-1-ylsulfonylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-methyl-4-nitro-5-propyl-N-[4-(pyrrolidin-1-ylsulfonylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-methyl-4-nitro-5-propyl-N-[4-(1-pyrrolidinylsulfonylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-methyl-4-nitro-5-propyl-N-[4-(pyrrolidin-1-ylsulfonylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-methyl-4-nitro-5-propyl-N-[4-(pyrrolidinosulfonylmethyl)phenyl]pyrazole-3-carboxamide Formula: C19H25N5O5S MolecularWeight: 435.4973

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CS(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCCC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CS(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C19H25N5O5S/c1-3-6-16-17(24(26)27)18(22(2)21-16)19(25)20-15-9-7-14(8-10-15)13-30(28,29)23-11-4-5-12-23/h7-10H,3-6,11-13H2,1-2H3,(H,20,25)