2-methyl-8-pentan-3-yl-4-[(2,4,6-trimethylphenyl)amino]-5,7-dihydropteridin-6-one

Systemtic Name: 2-methyl-8-pentan-3-yl-4-[(2,4,6-trimethylphenyl)amino]-5,7-dihydropteridin-6-one Openeye Name: 8-(1-ethylpropyl)-2-methyl-4-(2,4,6-trimethylanilino)-5,7-dihydropteridin-6-one CAS Name: 2-methyl-8-pentan-3-yl-4-(2,4,6-trimethylanilino)-5,7-dihydropteridin-6-one IUPAC Name: 2-methyl-8-pentan-3-yl-4-(2,4,6-trimethylanilino)-5,7-dihydropteridin-6-one Traditional Name: 8-(1-ethylpropyl)-4-mesidino-2-methyl-5,7-dihydropteridin-6-one Formula: C21H29N5O MolecularWeight: 367.48786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CC(=O)NC2=C1N=C(N=C2NC3=C(C=C(C=C3C)C)C)C

Isomeric SMILES

CCC(CC)N1CC(=O)NC2=C1N=C(N=C2NC3=C(C=C(C=C3C)C)C)C

InChI

InChI=1S/C21H29N5O/c1-7-16(8-2)26-11-17(27)24-19-20(22-15(6)23-21(19)26)25-18-13(4)9-12(3)10-14(18)5/h9-10,16H,7-8,11H2,1-6H3,(H,24,27)(H,22,23,25)