N-cycloheptyl-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-cycloheptyl-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-cycloheptyl-2-(7-isopropyl-3-methyl-2,4-dioxo-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-propanamide CAS Name: N-cycloheptyl-2-[(3-methyl-2,4-dioxo-7-propan-2-yl-1-propyl-5-pyrimido[4,5-d]pyrimidinyl)thio]propanamide IUPAC Name: N-cycloheptyl-2-(3-methyl-2,4-dioxo-7-propan-2-yl-1-propylpyrimido[4,5-d]pyrimidin-5-yl)sulfanylpropanamide Traditional Name: N-cycloheptyl-2-[(7-isopropyl-2,4-diketo-3-methyl-1-propyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]propionamide Formula: C23H35N5O3S MolecularWeight: 461.6207

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3CCCCCC3)C(=O)N(C1=O)C

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C(C)C)SC(C)C(=O)NC3CCCCCC3)C(=O)N(C1=O)C

InChI

InChI=1S/C23H35N5O3S/c1-6-13-28-19-17(22(30)27(5)23(28)31)21(26-18(25-19)14(2)3)32-15(4)20(29)24-16-11-9-7-8-10-12-16/h14-16H,6-13H2,1-5H3,(H,24,29)