pentyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioylamino)ethanoate

Systemtic Name: pentyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioylamino)ethanoate Openeye Name: pentyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioylamino)acetate CAS Name: 2-[[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]amino]acetic acid pentyl ester IUPAC Name: pentyl 2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioylamino)acetate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoylamino)acetic acid amyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CNC(=S)NC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCCCCOC(=O)CNC(=S)NC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C16H22N2O4S/c1-2-3-4-7-22-15(19)11-17-16(23)18-12-5-6-13-14(10-12)21-9-8-20-13/h5-6,10H,2-4,7-9,11H2,1H3,(H2,17,18,23)