S-(1,2,3-triazin-4-yl) 2-(butylcarbamoylamino)ethanethioate

Systemtic Name: S-(1,2,3-triazin-4-yl) 2-(butylcarbamoylamino)ethanethioate Openeye Name: S-(triazin-4-yl) 2-(butylcarbamoylamino)ethanethioate CAS Name: 2-[[butylamino(oxo)methyl]amino]ethanethioic acid S-(4-triazinyl) ester IUPAC Name: S-(triazin-4-yl) 2-(butylcarbamoylamino)ethanethioate Traditional Name: 2-(butylcarbamoylamino)ethanethioic acid S-(triazin-4-yl) ester Formula: C10H15N5O2S MolecularWeight: 269.3234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC(=O)SC1=NN=NC=C1

Isomeric SMILES

CCCCNC(=O)NCC(=O)SC1=NN=NC=C1

InChI

InChI=1S/C10H15N5O2S/c1-2-3-5-11-10(17)12-7-9(16)18-8-4-6-13-15-14-8/h4,6H,2-3,5,7H2,1H3,(H2,11,12,17)