2-(1-methylpyrazol-4-yl)-N-[2-(phenylmethyl)sulfonylethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-methylpyrazol-4-yl)-N-[2-(phenylmethyl)sulfonylethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(2-benzylsulfonylethyl)-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide CAS Name: 2-(1-methyl-4-pyrazolyl)-N-[2-(phenylmethyl)sulfonylethyl]-4-thiazolecarboxamide IUPAC Name: N-(2-benzylsulfonylethyl)-2-(1-methylpyrazol-4-yl)-1,3-thiazole-4-carboxamide Traditional Name: N-(2-benzylsulfonylethyl)-2-(1-methylpyrazol-4-yl)thiazole-4-carboxamide Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NCCS(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=CS2)C(=O)NCCS(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O3S2/c1-21-10-14(9-19-21)17-20-15(11-25-17)16(22)18-7-8-26(23,24)12-13-5-3-2-4-6-13/h2-6,9-11H,7-8,12H2,1H3,(H,18,22)