1-[1-[1-(3-chlorophenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]ethylamino]thiourea

Systemtic Name: 1-[1-[1-(3-chlorophenyl)-6-oxidanylidene-2-sulfanylidene-pyrimidin-5-ylidene]ethylamino]thiourea Openeye Name: [1-[1-(3-chlorophenyl)-6-oxo-2-thioxo-pyrimidin-5-ylidene]ethylamino]thiourea CAS Name: [1-[1-(3-chlorophenyl)-6-oxo-2-sulfanylidene-5-pyrimidinylidene]ethylamino]thiourea IUPAC Name: [1-[1-(3-chlorophenyl)-6-oxo-2-sulfanylidenepyrimidin-5-ylidene]ethylamino]thiourea Traditional Name: [1-[1-(3-chlorophenyl)-6-keto-2-thioxo-pyrimidin-5-ylidene]ethylamino]thiourea Formula: C13H12ClN5OS2 MolecularWeight: 353.85028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=NC(=S)N(C1=O)C2=CC(=CC=C2)Cl)NNC(=S)N

Isomeric SMILES

CC(=C1C=NC(=S)N(C1=O)C2=CC(=CC=C2)Cl)NNC(=S)N

InChI

InChI=1S/C13H12ClN5OS2/c1-7(17-18-12(15)21)10-6-16-13(22)19(11(10)20)9-4-2-3-8(14)5-9/h2-6,17H,1H3,(H3,15,18,21)