1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methyl-guanidine

Systemtic Name: 1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methyl-guanidine Openeye Name: 1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methyl-guanidine CAS Name: 1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methylguanidine IUPAC Name: 1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methylguanidine Traditional Name: 1-[[(2R,5R)-2-cyclohexyl-2-phenyl-1,3-oxathiolan-5-yl]methyl]-1-methyl-guanidine Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CSC(O1)(C2CCCCC2)C3=CC=CC=C3)C(=N)N

Isomeric SMILES

CN(C[C@@H]1CS[C@](O1)(C2CCCCC2)C3=CC=CC=C3)C(=N)N

InChI

InChI=1S/C18H27N3OS/c1-21(17(19)20)12-16-13-23-18(22-16,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15-16H,3,6-7,10-13H2,1H3,(H3,19,20)/t16-,18+/m1/s1