N-cyclohexyl-2-[3-methyl-2,4-bis(oxidanylidene)-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide

Systemtic Name: N-cyclohexyl-2-[3-methyl-2,4-bis(oxidanylidene)-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-propanamide Openeye Name: N-cyclohexyl-2-(7-isopropyl-3-methyl-2,4-dioxo-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-propanamide CAS Name: N-cyclohexyl-2-[(3-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-5-pyrimido[4,5-d]pyrimidinyl)thio]propanamide IUPAC Name: N-cyclohexyl-2-(3-methyl-2,4-dioxo-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidin-5-yl)sulfanylpropanamide Traditional Name: N-cyclohexyl-2-[(7-isopropyl-2,4-diketo-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]propionamide Formula: C22H33N5O3S MolecularWeight: 447.59412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3CCCCC3)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3CCCCC3)C(=O)N(C1=O)C

InChI

InChI=1S/C22H33N5O3S/c1-6-12-27-18-16(21(29)26(5)22(27)30)20(25-17(24-18)13(2)3)31-14(4)19(28)23-15-10-8-7-9-11-15/h13-15H,6-12H2,1-5H3,(H,23,28)