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

Systemtic Name: 1-cyclohexyl-3-[2-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylethanoylamino]thiourea Openeye Name: 1-cyclohexyl-3-[[2-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanylacetyl]amino]thiourea CAS Name: 1-cyclohexyl-3-[[2-[[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-cyclohexyl-3-[[2-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanylacetyl]amino]thiourea Traditional Name: 1-cyclohexyl-3-[[2-[(4-methyl-6-pyrrolidino-pyrimidin-2-yl)thio]acetyl]amino]thiourea Formula: C18H28N6OS2 MolecularWeight: 408.58452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NNC(=S)NC2CCCCC2)N3CCCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NNC(=S)NC2CCCCC2)N3CCCC3

InChI

InChI=1S/C18H28N6OS2/c1-13-11-15(24-9-5-6-10-24)21-18(19-13)27-12-16(25)22-23-17(26)20-14-7-3-2-4-8-14/h11,14H,2-10,12H2,1H3,(H,22,25)(H2,20,23,26)