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

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl N'-(2-methoxyethyl)carbamimidothioate Openeye Name: 2-[(7-ethyl-2-oxo-chromen-4-yl)methyl]-3-(2-methoxyethyl)isothiourea CAS Name: N'-(2-methoxyethyl)carbamimidothioic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl N'-(2-methoxyethyl)carbamimidothioate Traditional Name: 2-[(7-ethyl-2-keto-chromen-4-yl)methyl]-3-(2-methoxyethyl)isothiourea Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O3S/c1-3-11-4-5-13-12(9-15(19)21-14(13)8-11)10-22-16(17)18-6-7-20-2/h4-5,8-9H,3,6-7,10H2,1-2H3,(H2,17,18)