1-butyl-5-chloranyl-3-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-butyl-5-chloranyl-3-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: 1-butyl-5-chloro-3-methyl-N-[(2-morpholinosulfonylphenyl)methyl]pyrazole-4-carboxamide CAS Name: 1-butyl-5-chloro-3-methyl-N-[[2-(4-morpholinylsulfonyl)phenyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-butyl-5-chloro-3-methyl-N-[(2-morpholin-4-ylsulfonylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: 1-butyl-5-chloro-3-methyl-N-(2-morpholinosulfonylbenzyl)pyrazole-4-carboxamide Formula: C20H27ClN4O4S MolecularWeight: 454.97078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCOCC3)Cl

InChI

InChI=1S/C20H27ClN4O4S/c1-3-4-9-25-19(21)18(15(2)23-25)20(26)22-14-16-7-5-6-8-17(16)30(27,28)24-10-12-29-13-11-24/h5-8H,3-4,9-14H2,1-2H3,(H,22,26)