N-(1,3-benzodioxol-4-ylcarbamothioylamino)-N-propyl-carbamate

Systemtic Name: N-(1,3-benzodioxol-4-ylcarbamothioylamino)-N-propyl-carbamate Openeye Name: N-(1,3-benzodioxol-4-ylcarbamothioylamino)-N-propyl-carbamate CAS Name: N-[[(1,3-benzodioxol-4-ylamino)-sulfanylidenemethyl]amino]-N-propylcarbamate IUPAC Name: N-(1,3-benzodioxol-4-ylcarbamothioylamino)-N-propylcarbamate Traditional Name: N-(1,3-benzodioxol-4-ylthiocarbamoylamino)-N-propyl-carbamate Formula: C12H14N3O4S- MolecularWeight: 296.32226

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)[O-])NC(=S)NC1=C2C(=CC=C1)OCO2

Isomeric SMILES

CCCN(C(=O)[O-])NC(=S)NC1=C2C(=CC=C1)OCO2

InChI

InChI=1S/C12H15N3O4S/c1-2-6-15(12(16)17)14-11(20)13-8-4-3-5-9-10(8)19-7-18-9/h3-5H,2,6-7H2,1H3,(H,16,17)(H2,13,14,20)/p-1