3-(4,6-dimethoxypyrimidin-2-yl)-1-(2-prop-1-ynylphenyl)-1-sulfamoyl-urea

Systemtic Name: 3-(4,6-dimethoxypyrimidin-2-yl)-1-(2-prop-1-ynylphenyl)-1-sulfamoyl-urea Openeye Name: 3-(4,6-dimethoxypyrimidin-2-yl)-1-(2-prop-1-ynylphenyl)-1-sulfamoyl-urea CAS Name: 3-(4,6-dimethoxy-2-pyrimidinyl)-1-(2-prop-1-ynylphenyl)-1-sulfamoylurea IUPAC Name: 3-(4,6-dimethoxypyrimidin-2-yl)-1-(2-prop-1-ynylphenyl)-1-sulfamoylurea Traditional Name: 3-(4,6-dimethoxypyrimidin-2-yl)-1-(2-prop-1-ynylphenyl)-1-sulfamoyl-urea Formula: C16H17N5O5S MolecularWeight: 391.40168

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC1=CC=CC=C1N(C(=O)NC2=NC(=CC(=N2)OC)OC)S(=O)(=O)N

Isomeric SMILES

CC#CC1=CC=CC=C1N(C(=O)NC2=NC(=CC(=N2)OC)OC)S(=O)(=O)N

InChI

InChI=1S/C16H17N5O5S/c1-4-7-11-8-5-6-9-12(11)21(27(17,23)24)16(22)20-15-18-13(25-2)10-14(19-15)26-3/h5-6,8-10H,1-3H3,(H2,17,23,24)(H,18,19,20,22)