(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-propylcarbamimidothioate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-propylcarbamimidothioate Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]-3-propyl-isothiourea CAS Name: N'-propylcarbamimidothioic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl N'-propylcarbamimidothioate Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]-3-propyl-isothiourea Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(N)SCC1=CC(=O)OC2=CC(=C(C=C12)C)C

Isomeric SMILES

CCCN=C(N)SCC1=CC(=O)OC2=CC(=C(C=C12)C)C

InChI

InChI=1S/C16H20N2O2S/c1-4-5-18-16(17)21-9-12-8-15(19)20-14-7-11(3)10(2)6-13(12)14/h6-8H,4-5,9H2,1-3H3,(H2,17,18)