1-(3-chloranyl-4-methyl-phenyl)-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea Formula: C14H14ClN5O2S2 MolecularWeight: 383.87626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CC2=CC(=O)NC(=S)N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CC2=CC(=O)NC(=S)N2)Cl

InChI

InChI=1S/C14H14ClN5O2S2/c1-7-2-3-8(4-10(7)15)16-14(24)20-19-12(22)6-9-5-11(21)18-13(23)17-9/h2-5H,6H2,1H3,(H,19,22)(H2,16,20,24)(H2,17,18,21,23)