(4-chlorophenyl) (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-propanimidothioate

Systemtic Name: (4-chlorophenyl) (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-propanimidothioate Openeye Name: (4-chlorophenyl) (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-oxo-propanimidothioate CAS Name: (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-oxopropanimidothioic acid (4-chlorophenyl) ester IUPAC Name: (4-chlorophenyl) (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-oxopropanimidothioate Traditional Name: (1Z)-N-(1,3-benzodioxol-5-ylamino)-2-keto-thiopropionimidic acid (4-chlorophenyl) ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=CC2=C(C=C1)OCO2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)/C(=N/NC1=CC2=C(C=C1)OCO2)/SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O3S/c1-10(20)16(23-13-5-2-11(17)3-6-13)19-18-12-4-7-14-15(8-12)22-9-21-14/h2-8,18H,9H2,1H3/b19-16-