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

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl N,N'-diethylcarbamimidothioate Openeye Name: 1,3-diethyl-2-[(7-methoxy-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N,N'-diethylcarbamimidothioic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl N,N'-diethylcarbamimidothioate Traditional Name: 1,3-diethyl-2-[(2-keto-7-methoxy-chromen-4-yl)methyl]isothiourea Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=NCC)SCC1=CC(=O)OC2=C1C=CC(=C2)OC

Isomeric SMILES

CCNC(=NCC)SCC1=CC(=O)OC2=C1C=CC(=C2)OC

InChI

InChI=1S/C16H20N2O3S/c1-4-17-16(18-5-2)22-10-11-8-15(19)21-14-9-12(20-3)6-7-13(11)14/h6-9H,4-5,10H2,1-3H3,(H,17,18)