1-[[2-(4-chloranylbutanoyl)pyrrol-1-yl]amino]-1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea

Systemtic Name: 1-[[2-(4-chloranylbutanoyl)pyrrol-1-yl]amino]-1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea Openeye Name: 1-[[2-(4-chlorobutanoyl)pyrrol-1-yl]amino]-1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea CAS Name: 1-[[2-(4-chloro-1-oxobutyl)-1-pyrrolyl]amino]-1-(4,6-dimethoxy-2-pyrimidinyl)-3-sulfonylurea IUPAC Name: 1-[[2-(4-chlorobutanoyl)pyrrol-1-yl]amino]-1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonylurea Traditional Name: 1-[[2-(4-chlorobutanoyl)pyrrol-1-yl]amino]-1-(4,6-dimethoxypyrimidin-2-yl)-3-sulfonyl-urea Formula: C15H17ClN6O6S MolecularWeight: 444.85008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)N(C(=O)N=S(=O)=O)NN2C=CC=C2C(=O)CCCCl)OC

Isomeric SMILES

COC1=CC(=NC(=N1)N(C(=O)N=S(=O)=O)NN2C=CC=C2C(=O)CCCCl)OC

InChI

InChI=1S/C15H17ClN6O6S/c1-27-12-9-13(28-2)18-14(17-12)22(15(24)19-29(25)26)20-21-8-4-5-10(21)11(23)6-3-7-16/h4-5,8-9,20H,3,6-7H2,1-2H3