3-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-1-methyl-1-(4-methyl-4-oxidanyl-cyclohexyl)urea

Systemtic Name: 3-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-1-methyl-1-(4-methyl-4-oxidanyl-cyclohexyl)urea Openeye Name: 1-(4-hydroxy-4-methyl-cyclohexyl)-3-(4-methoxy-7-tetrahydropyran-4-yl-1,3-benzothiazol-2-yl)-1-methyl-urea CAS Name: 1-(4-hydroxy-4-methylcyclohexyl)-3-[4-methoxy-7-(4-oxanyl)-1,3-benzothiazol-2-yl]-1-methylurea IUPAC Name: 1-(4-hydroxy-4-methylcyclohexyl)-3-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-1-methylurea Traditional Name: 1-(4-hydroxy-4-methyl-cyclohexyl)-3-(4-methoxy-7-tetrahydropyran-4-yl-1,3-benzothiazol-2-yl)-1-methyl-urea Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)N(C)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC)O

Isomeric SMILES

CC1(CCC(CC1)N(C)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC)O

InChI

InChI=1S/C22H31N3O4S/c1-22(27)10-6-15(7-11-22)25(2)21(26)24-20-23-18-17(28-3)5-4-16(19(18)30-20)14-8-12-29-13-9-14/h4-5,14-15,27H,6-13H2,1-3H3,(H,23,24,26)