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

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-cyclopentylcarbamimidothioate Openeye Name: 3-cyclopentyl-2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N'-cyclopentylcarbamimidothioic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl N'-cyclopentylcarbamimidothioate Traditional Name: 3-cyclopentyl-2-[(2-keto-6,7-dimethyl-chromen-4-yl)methyl]isothiourea Formula: C18H22N2O2S MolecularWeight: 330.44448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC(=NC3CCCC3)N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC(=NC3CCCC3)N)C

InChI

InChI=1S/C18H22N2O2S/c1-11-7-15-13(9-17(21)22-16(15)8-12(11)2)10-23-18(19)20-14-5-3-4-6-14/h7-9,14H,3-6,10H2,1-2H3,(H2,19,20)