(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-tert-butylcarbamimidothioate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl N'-tert-butylcarbamimidothioate Openeye Name: 3-tert-butyl-2-[(7,8-dimethyl-2-oxo-chromen-4-yl)methyl]isothiourea CAS Name: N'-tert-butylcarbamimidothioic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl N'-tert-butylcarbamimidothioate Traditional Name: 3-tert-butyl-2-[(2-keto-7,8-dimethyl-chromen-4-yl)methyl]isothiourea Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC(=NC(C)(C)C)N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)CSC(=NC(C)(C)C)N)C

InChI

InChI=1S/C17H22N2O2S/c1-10-6-7-13-12(8-14(20)21-15(13)11(10)2)9-22-16(18)19-17(3,4)5/h6-8H,9H2,1-5H3,(H2,18,19)