2-[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxidanylidene-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[2-oxo-2-[[3-(p-tolylmethyl)thiazol-2-ylidene]amino]ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[2-[[3-[(4-methylphenyl)methyl]-2-thiazolylidene]amino]-2-oxoethyl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[2-[[3-[(4-methylphenyl)methyl]-1,3-thiazol-2-ylidene]amino]-2-oxoethyl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-[[3-(4-methylbenzyl)-4-thiazolin-2-ylidene]amino]ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C20H21N4O2S2- MolecularWeight: 413.53634

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SCC(=O)N=C2N(C=CS2)CC3=CC=C(C=C3)C)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)SCC(=O)N=C2N(C=CS2)CC3=CC=C(C=C3)C)[O-]

InChI

InChI=1S/C20H22N4O2S2/c1-3-4-16-11-17(25)22-19(21-16)28-13-18(26)23-20-24(9-10-27-20)12-15-7-5-14(2)6-8-15/h5-11H,3-4,12-13H2,1-2H3,(H,21,22,25)/p-1