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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-methylcarbamimidothioate Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-3-methyl-isothiourea CAS Name: N'-methylcarbamimidothioic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl N'-methylcarbamimidothioate Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-3-methyl-isothiourea Formula: C14H16N2O2S MolecularWeight: 276.35404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC(=NC)N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC(=NC)N)C

InChI

InChI=1S/C14H16N2O2S/c1-8-4-11-10(7-19-14(15)16-3)6-13(17)18-12(11)5-9(8)2/h4-6H,7H2,1-3H3,(H2,15,16)