(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-azanyl-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 3-azanyl-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 3-amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylate CAS Name: 3-amino-4,6-dimethyl-2-thieno[2,3-b]pyridinecarboxylic 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-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carboxylate Traditional Name: 3-amino-4,6-dimethyl-thieno[2,3-b]pyridine-2-carboxylic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C20H19N7O2S MolecularWeight: 421.47556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=C(S2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)N)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=C(S2)C(=O)OCC3=NC(=NC(=N3)NC4=CC=CC=C4)N)N)C

InChI

InChI=1S/C20H19N7O2S/c1-10-8-11(2)23-17-14(10)15(21)16(30-17)18(28)29-9-13-25-19(22)27-20(26-13)24-12-6-4-3-5-7-12/h3-8H,9,21H2,1-2H3,(H3,22,24,25,26,27)