1-cyclohexyl-3-[2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylethanoylamino]thiourea

Systemtic Name: 1-cyclohexyl-3-[2-(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylethanoylamino]thiourea Openeye Name: 1-cyclohexyl-3-[[2-(4-methyl-6-morpholino-pyrimidin-2-yl)sulfanylacetyl]amino]thiourea CAS Name: 1-cyclohexyl-3-[[2-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[[2-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylacetyl]amino]thiourea Traditional Name: 1-cyclohexyl-3-[[2-[(4-methyl-6-morpholino-pyrimidin-2-yl)thio]acetyl]amino]thiourea Formula: C18H28N6O2S2 MolecularWeight: 424.58392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NNC(=S)NC2CCCCC2)N3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NNC(=S)NC2CCCCC2)N3CCOCC3

InChI

InChI=1S/C18H28N6O2S2/c1-13-11-15(24-7-9-26-10-8-24)21-18(19-13)28-12-16(25)22-23-17(27)20-14-5-3-2-4-6-14/h11,14H,2-10,12H2,1H3,(H,22,25)(H2,20,23,27)