(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-phenylsulfanylpropanoate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-phenylsulfanylpropanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic 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 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C19H19N5O2S MolecularWeight: 381.45146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCSC3=CC=CC=C3

InChI

InChI=1S/C19H19N5O2S/c20-18-22-16(23-19(24-18)21-14-7-3-1-4-8-14)13-26-17(25)11-12-27-15-9-5-2-6-10-15/h1-10H,11-13H2,(H3,20,21,22,23,24)