N2-[(2S)-2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-[(2S)-2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine Openeye Name: N2-[(2S)-2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine CAS Name: N2-[(2S)-2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-[(2S)-2-(4-butoxyphenyl)propyl]-1,3,5-triazine-2,4-diamine Traditional Name: (4-amino-s-triazin-2-yl)-[(2S)-2-(4-butoxyphenyl)propyl]amine Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)CNC2=NC=NC(=N2)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@H](C)CNC2=NC=NC(=N2)N

InChI

InChI=1S/C16H23N5O/c1-3-4-9-22-14-7-5-13(6-8-14)12(2)10-18-16-20-11-19-15(17)21-16/h5-8,11-12H,3-4,9-10H2,1-2H3,(H3,17,18,19,20,21)/t12-/m1/s1