(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl ester IUPAC Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H26N6O4 MolecularWeight: 402.44754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)OCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

InChI

InChI=1S/C19H26N6O4/c1-19(2,3)29-18(27)21-11-7-10-15(26)28-12-14-23-16(20)25-17(24-14)22-13-8-5-4-6-9-13/h4-6,8-9H,7,10-12H2,1-3H3,(H,21,27)(H3,20,22,23,24,25)