2,6-bis(chloranyl)-4-[(3-methoxypropylcarbamothioylamino)carbamoyl]phenolate

Systemtic Name: 2,6-bis(chloranyl)-4-[(3-methoxypropylcarbamothioylamino)carbamoyl]phenolate Openeye Name: 2,6-dichloro-4-[(3-methoxypropylcarbamothioylamino)carbamoyl]phenolate CAS Name: 2,6-dichloro-4-[[[(3-methoxypropylamino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenolate IUPAC Name: 2,6-dichloro-4-[(3-methoxypropylcarbamothioylamino)carbamoyl]phenolate Traditional Name: 2,6-dichloro-4-[(3-methoxypropylthiocarbamoylamino)carbamoyl]phenolate Formula: C12H14Cl2N3O3S- MolecularWeight: 351.22886

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NNC(=O)C1=CC(=C(C(=C1)Cl)[O-])Cl

Isomeric SMILES

COCCCNC(=S)NNC(=O)C1=CC(=C(C(=C1)Cl)[O-])Cl

InChI

InChI=1S/C12H15Cl2N3O3S/c1-20-4-2-3-15-12(21)17-16-11(19)7-5-8(13)10(18)9(14)6-7/h5-6,18H,2-4H2,1H3,(H,16,19)(H2,15,17,21)/p-1