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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl N,N'-diethylcarbamimidothioate Openeye Name: 2-[(6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl]-1,3-diethyl-isothiourea CAS Name: N,N'-diethylcarbamimidothioic 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,N'-diethylcarbamimidothioate Traditional Name: 2-[(6-chloro-2-keto-7-methyl-chromen-4-yl)methyl]-1,3-diethyl-isothiourea Formula: C16H19ClN2O2S MolecularWeight: 338.85226

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=NCC)SCC1=CC(=O)OC2=CC(=C(C=C12)Cl)C

Isomeric SMILES

CCNC(=NCC)SCC1=CC(=O)OC2=CC(=C(C=C12)Cl)C

InChI

InChI=1S/C16H19ClN2O2S/c1-4-18-16(19-5-2)22-9-11-7-15(20)21-14-6-10(3)13(17)8-12(11)14/h6-8H,4-5,9H2,1-3H3,(H,18,19)