2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-[(2S)-3-methylbutan-2-yl]ethanamide

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-[(2S)-3-methylbutan-2-yl]ethanamide Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-[(1S)-1,2-dimethylpropyl]acetamide CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-N-[(2S)-3-methylbutan-2-yl]acetamide IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-[(2S)-3-methylbutan-2-yl]acetamide Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-N-[(1S)-1,2-dimethylpropyl]acetamide Formula: C17H24N6OS MolecularWeight: 360.47706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

Isomeric SMILES

C[C@@H](C(C)C)NC(=O)CSCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

InChI

InChI=1S/C17H24N6OS/c1-11(2)12(3)19-15(24)10-25-9-14-21-16(18)23-17(22-14)20-13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3,(H,19,24)(H3,18,20,21,22,23)/t12-/m0/s1