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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl N'-ethylcarbamimidothioate Openeye Name: 3-ethyl-2-[(7-ethyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N'-ethylcarbamimidothioic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl N'-ethylcarbamimidothioate Traditional Name: 3-ethyl-2-[(7-ethyl-2-keto-chromen-4-yl)methyl]isothiourea Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O2S/c1-3-10-5-6-12-11(9-20-15(16)17-4-2)8-14(18)19-13(12)7-10/h5-8H,3-4,9H2,1-2H3,(H2,16,17)