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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl N'-prop-2-enylcarbamimidothioate Openeye Name: 3-allyl-2-[(7-ethyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N'-prop-2-enylcarbamimidothioic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl N'-prop-2-enylcarbamimidothioate Traditional Name: 3-allyl-2-[(7-ethyl-2-keto-chromen-4-yl)methyl]isothiourea Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O2S/c1-3-7-18-16(17)21-10-12-9-15(19)20-14-8-11(4-2)5-6-13(12)14/h3,5-6,8-9H,1,4,7,10H2,2H3,(H2,17,18)