3-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methylsulfonyl-thiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methylsulfonyl-thiophene-2-carboxamide Openeye Name: 3-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methylsulfonyl-thiophene-2-carboxamide CAS Name: 3-chloro-N-[4-[[4-(dimethylamino)-2-pyrimidinyl]amino]cyclohexyl]-4-methylsulfonyl-2-thiophenecarboxamide IUPAC Name: 3-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-methylsulfonylthiophene-2-carboxamide Traditional Name: 3-chloro-N-[4-[[4-(dimethylamino)pyrimidin-2-yl]amino]cyclohexyl]-4-mesyl-thiophene-2-carboxamide Formula: C18H24ClN5O3S2 MolecularWeight: 457.99786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl

Isomeric SMILES

CN(C)C1=NC(=NC=C1)NC2CCC(CC2)NC(=O)C3=C(C(=CS3)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H24ClN5O3S2/c1-24(2)14-8-9-20-18(23-14)22-12-6-4-11(5-7-12)21-17(25)16-15(19)13(10-28-16)29(3,26)27/h8-12H,4-7H2,1-3H3,(H,21,25)(H,20,22,23)