(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl N,N'-dimethylcarbamimidothioate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl N,N'-dimethylcarbamimidothioate Openeye Name: 2-[(6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl N,N'-dimethylcarbamimidothioate Traditional Name: 2-[(6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl]-1,3-dimethyl-isothiourea Formula: C17H22N2O2S MolecularWeight: 318.43378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NC)NC)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CSC(=NC)NC)C(C)C

InChI

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