N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide

Systemtic Name: N-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-1-(phenylmethyl)-3-thiophen-2-yl-pyrazole-4-sulfonamide Openeye Name: 1-benzyl-N-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)-3-(2-thienyl)pyrazole-4-sulfonamide CAS Name: N-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolesulfonamide IUPAC Name: 1-benzyl-N-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-3-thiophen-2-ylpyrazole-4-sulfonamide Traditional Name: 1-benzyl-N-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)-3-(2-thienyl)pyrazole-4-sulfonamide Formula: C20H19N5O4S2 MolecularWeight: 457.52596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NS(=O)(=O)C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O4S2/c1-23-17(11-18(26)24(2)20(23)27)22-31(28,29)16-13-25(12-14-7-4-3-5-8-14)21-19(16)15-9-6-10-30-15/h3-11,13,22H,12H2,1-2H3