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

Systemtic Name: 1-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]-3-(4-propan-2-ylphenyl)thiourea Openeye Name: 1-(4-isopropylphenyl)-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]-3-(4-propan-2-ylphenyl)thiourea IUPAC Name: 1-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]-3-(4-propan-2-ylphenyl)thiourea Traditional Name: 1-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]-3-p-cumenyl-thiourea Formula: C16H19N5O2S2 MolecularWeight: 377.48436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O2S2/c1-9(2)10-3-5-11(6-4-10)17-16(25)21-20-14(23)8-12-7-13(22)19-15(24)18-12/h3-7,9H,8H2,1-2H3,(H,20,23)(H2,17,21,25)(H2,18,19,22,24)