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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-thiophen-2-ylpropanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-(2-thienyl)propanoate CAS Name: 3-thiophen-2-ylpropanoic 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-thiophen-2-ylpropanoate Traditional Name: 3-(2-thienyl)propionic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C17H17N5O2S MolecularWeight: 355.41418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CCC3=CC=CS3

InChI

InChI=1S/C17H17N5O2S/c18-16-20-14(11-24-15(23)9-8-13-7-4-10-25-13)21-17(22-16)19-12-5-2-1-3-6-12/h1-7,10H,8-9,11H2,(H3,18,19,20,21,22)