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

Systemtic Name: (4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methyl 2-(thiophen-2-ylcarbonylamino)ethanoate Openeye Name: (4-amino-6-anilino-1,3,5-triazin-2-yl)methyl 2-(thiophene-2-carbonylamino)acetate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]acetic 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 2-(thiophene-2-carbonylamino)acetate Traditional Name: 2-(2-thenoylamino)acetic acid (4-amino-6-anilino-s-triazin-2-yl)methyl ester Formula: C17H16N6O3S MolecularWeight: 384.41234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)COC(=O)CNC(=O)C3=CC=CS3

InChI

InChI=1S/C17H16N6O3S/c18-16-21-13(22-17(23-16)20-11-5-2-1-3-6-11)10-26-14(24)9-19-15(25)12-7-4-8-27-12/h1-8H,9-10H2,(H,19,25)(H3,18,20,21,22,23)