1-(4,6-dimethoxypyrimidin-2-yl)-3-[[2-(3-methylbutyl)-3H-1,2-benzothiazol-7-yl]sulfonyl]urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[[2-(3-methylbutyl)-3H-1,2-benzothiazol-7-yl]sulfonyl]urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(2-isopentyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-[[2-(3-methylbutyl)-3H-1,2-benzothiazol-7-yl]sulfonyl]urea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[[2-(3-methylbutyl)-3H-1,2-benzothiazol-7-yl]sulfonyl]urea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(2-isoamyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea Formula: C19H25N5O5S2 MolecularWeight: 467.5623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC

Isomeric SMILES

CC(C)CCN1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC

InChI

InChI=1S/C19H25N5O5S2/c1-12(2)8-9-24-11-13-6-5-7-14(17(13)30-24)31(26,27)23-19(25)22-18-20-15(28-3)10-16(21-18)29-4/h5-7,10,12H,8-9,11H2,1-4H3,(H2,20,21,22,23,25)