[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: [4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-methyl-2-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-methyl-2-(thiophene-2-carbonylamino)butanoate CAS Name: 3-methyl-2-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl 3-methyl-2-(thiophene-2-carbonylamino)butanoate Traditional Name: 3-methyl-2-(2-thenoylamino)butyric acid [4-amino-6-(dimethylamino)-s-triazin-2-yl]methyl ester Formula: C16H22N6O3S MolecularWeight: 378.44928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=NC(=NC(=N1)N(C)C)N)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)OCC1=NC(=NC(=N1)N(C)C)N)NC(=O)C2=CC=CS2

InChI

InChI=1S/C16H22N6O3S/c1-9(2)12(20-13(23)10-6-5-7-26-10)14(24)25-8-11-18-15(17)21-16(19-11)22(3)4/h5-7,9,12H,8H2,1-4H3,(H,20,23)(H2,17,18,19,21)