(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl N'-methylcarbamimidothioate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl N'-methylcarbamimidothioate Openeye Name: 2-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl]-3-methyl-isothiourea CAS Name: N'-methylcarbamimidothioic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl N'-methylcarbamimidothioate Traditional Name: 2-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methyl]-3-methyl-isothiourea Formula: C13H13ClN2O2S MolecularWeight: 296.77252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NC)N)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NC)N)Cl

InChI

InChI=1S/C13H13ClN2O2S/c1-7-3-11-9(5-10(7)14)8(4-12(17)18-11)6-19-13(15)16-2/h3-5H,6H2,1-2H3,(H2,15,16)