1-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-[[2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]-3-phenyl-thiourea CAS Name: 1-[[1-oxo-2-[(6-oxo-1H-pyrimidin-2-yl)thio]ethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]-3-phenylthiourea Traditional Name: 1-[[2-[(6-keto-1H-pyrimidin-2-yl)thio]acetyl]amino]-3-phenyl-thiourea Formula: C13H13N5O2S2 MolecularWeight: 335.40462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC=CC(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NNC(=O)CSC2=NC=CC(=O)N2

InChI

InChI=1S/C13H13N5O2S2/c19-10-6-7-14-13(16-10)22-8-11(20)17-18-12(21)15-9-4-2-1-3-5-9/h1-7H,8H2,(H,17,20)(H,14,16,19)(H2,15,18,21)