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

Systemtic Name: 2-[3-methyl-2,4-bis(oxidanylidene)-7-propan-2-yl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-N-phenyl-propanamide Openeye Name: 2-(7-isopropyl-3-methyl-2,4-dioxo-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-phenyl-propanamide CAS Name: 2-[(3-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-5-pyrimido[4,5-d]pyrimidinyl)thio]-N-phenylpropanamide IUPAC Name: 2-(3-methyl-2,4-dioxo-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-N-phenylpropanamide Traditional Name: 2-[(7-isopropyl-2,4-diketo-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]-N-phenyl-propionamide Formula: C22H27N5O3S MolecularWeight: 441.54648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3=CC=CC=C3)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3=CC=CC=C3)C(=O)N(C1=O)C

InChI

InChI=1S/C22H27N5O3S/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/h7-11,13-14H,6,12H2,1-5H3,(H,23,28)