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

Systemtic Name: 1-(3-methylphenyl)-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea Openeye Name: 1-(m-tolyl)-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-(3-methylphenyl)-3-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]thiourea IUPAC Name: 1-(3-methylphenyl)-3-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]thiourea Traditional Name: 1-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]-3-(m-tolyl)thiourea Formula: C14H15N5O2S2 MolecularWeight: 349.4312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O2S2/c1-8-3-2-4-9(5-8)15-14(23)19-18-12(21)7-10-6-11(20)17-13(22)16-10/h2-6H,7H2,1H3,(H,18,21)(H2,15,19,23)(H2,16,17,20,22)