4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]butanamide

Systemtic Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Openeye Name: 4-[methyl(2-thienylsulfonyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]butanamide CAS Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(1-phenyl-4-pyrazolyl)methyl]butanamide IUPAC Name: 4-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]butanamide Traditional Name: 4-[methyl(2-thienylsulfonyl)amino]-N-[(1-phenylpyrazol-4-yl)methyl]butyramide Formula: C19H22N4O3S2 MolecularWeight: 418.53298

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)NCC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CCCC(=O)NCC1=CN(N=C1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H22N4O3S2/c1-22(28(25,26)19-10-6-12-27-19)11-5-9-18(24)20-13-16-14-21-23(15-16)17-7-3-2-4-8-17/h2-4,6-8,10,12,14-15H,5,9,11,13H2,1H3,(H,20,24)