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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl N,N'-diethylcarbamimidothioate Openeye Name: 1,3-diethyl-2-[(7-ethyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N,N'-diethylcarbamimidothioic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl N,N'-diethylcarbamimidothioate Traditional Name: 1,3-diethyl-2-[(7-ethyl-2-keto-chromen-4-yl)methyl]isothiourea Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC(=NCC)NCC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC(=NCC)NCC

InChI

InChI=1S/C17H22N2O2S/c1-4-12-7-8-14-13(10-16(20)21-15(14)9-12)11-22-17(18-5-2)19-6-3/h7-10H,4-6,11H2,1-3H3,(H,18,19)