[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Openeye Name: (1-allophanoyl-2-methyl-propyl) 2-(allylamino)thiazole-4-carboxylate CAS Name: 2-(prop-2-enylamino)-4-thiazolecarboxylic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 2-(prop-2-enylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(allylamino)thiazole-4-carboxylic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C13H18N4O4S MolecularWeight: 326.37142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CSC(=N1)NCC=C

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CSC(=N1)NCC=C

InChI

InChI=1S/C13H18N4O4S/c1-4-5-15-13-16-8(6-22-13)11(19)21-9(7(2)3)10(18)17-12(14)20/h4,6-7,9H,1,5H2,2-3H3,(H,15,16)(H3,14,17,18,20)