methyl 2-(1,2-benzoxazol-3-ylcarbamothioylamino)ethanoate

Systemtic Name: methyl 2-(1,2-benzoxazol-3-ylcarbamothioylamino)ethanoate Openeye Name: methyl 2-(1,2-benzoxazol-3-ylcarbamothioylamino)acetate CAS Name: 2-[[(1,2-benzoxazol-3-ylamino)-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-(1,2-benzoxazol-3-ylcarbamothioylamino)acetate Traditional Name: 2-(indoxazen-3-ylthiocarbamoylamino)acetic acid methyl ester Formula: C11H11N3O3S MolecularWeight: 265.28834

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=S)NC1=NOC2=CC=CC=C21

Isomeric SMILES

COC(=O)CNC(=S)NC1=NOC2=CC=CC=C21

InChI

InChI=1S/C11H11N3O3S/c1-16-9(15)6-12-11(18)13-10-7-4-2-3-5-8(7)17-14-10/h2-5H,6H2,1H3,(H2,12,13,14,18)