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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

Isomeric SMILES

CC(C(=O)N(C)C1=CC=CC=C1)SC2=NC(=NC3=C2C(=O)N(C(=O)N3C)C)C(C)(C)C

InChI

InChI=1S/C22H27N5O3S/c1-13(18(28)25(5)14-11-9-8-10-12-14)31-17-15-16(23-20(24-17)22(2,3)4)26(6)21(30)27(7)19(15)29/h8-13H,1-7H3