(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl N'-propan-2-ylcarbamimidothioate

Systemtic Name: (4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl N'-propan-2-ylcarbamimidothioate Openeye Name: 3-isopropyl-2-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]isothiourea CAS Name: N'-propan-2-ylcarbamimidothioic acid (4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl N'-propan-2-ylcarbamimidothioate Traditional Name: 3-isopropyl-2-[[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]isothiourea Formula: C15H16N4OS3 MolecularWeight: 364.50874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(N)SCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

Isomeric SMILES

CC(C)N=C(N)SCC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1

InChI

InChI=1S/C15H16N4OS3/c1-8(2)17-15(16)23-7-11-18-13(20)12-9(6-22-14(12)19-11)10-4-3-5-21-10/h3-6,8H,7H2,1-2H3,(H2,16,17)(H,18,19,20)