methyl 3-[[(2R)-1-oxidanylbutan-2-yl]carbamothioylamino]pyrazine-2-carboxylate

Systemtic Name: methyl 3-[[(2R)-1-oxidanylbutan-2-yl]carbamothioylamino]pyrazine-2-carboxylate Openeye Name: methyl 3-[[(1R)-1-(hydroxymethyl)propyl]carbamothioylamino]pyrazine-2-carboxylate CAS Name: 3-[[[[(2R)-1-hydroxybutan-2-yl]amino]-sulfanylidenemethyl]amino]-2-pyrazinecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(2R)-1-hydroxybutan-2-yl]carbamothioylamino]pyrazine-2-carboxylate Traditional Name: 3-[[(1R)-1-methylolpropyl]thiocarbamoylamino]pyrazinic acid methyl ester Formula: C11H16N4O3S MolecularWeight: 284.33474

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=S)NC1=NC=CN=C1C(=O)OC

Isomeric SMILES

CC[C@H](CO)NC(=S)NC1=NC=CN=C1C(=O)OC

InChI

InChI=1S/C11H16N4O3S/c1-3-7(6-16)14-11(19)15-9-8(10(17)18-2)12-4-5-13-9/h4-5,7,16H,3,6H2,1-2H3,(H2,13,14,15,19)/t7-/m1/s1