propan-2-yl 2-chloranyl-5-[6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-1,3,5-triazin-3-yl]benzoate

Systemtic Name: propan-2-yl 2-chloranyl-5-[6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-1,3,5-triazin-3-yl]benzoate Openeye Name: isopropyl 2-chloro-5-(6-methylsulfanyl-2,4-dioxo-1H-1,3,5-triazin-3-yl)benzoate CAS Name: 2-chloro-5-[6-(methylthio)-2,4-dioxo-1H-1,3,5-triazin-3-yl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-chloro-5-(6-methylsulfanyl-2,4-dioxo-1H-1,3,5-triazin-3-yl)benzoate Traditional Name: 2-chloro-5-[2,4-diketo-6-(methylthio)-1H-s-triazin-3-yl]benzoic acid isopropyl ester Formula: C14H14ClN3O4S MolecularWeight: 355.79666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(C=CC(=C1)N2C(=O)NC(=NC2=O)SC)Cl

Isomeric SMILES

CC(C)OC(=O)C1=C(C=CC(=C1)N2C(=O)NC(=NC2=O)SC)Cl

InChI

InChI=1S/C14H14ClN3O4S/c1-7(2)22-11(19)9-6-8(4-5-10(9)15)18-13(20)16-12(23-3)17-14(18)21/h4-7H,1-3H3,(H,16,17,20,21)