methyl N'-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-N-propan-2-yl-carbamimidothioate

Systemtic Name: methyl N'-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-N-propan-2-yl-carbamimidothioate Openeye Name: 1-isopropyl-3-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-2-methyl-isothiourea CAS Name: N'-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-N-propan-2-ylcarbamimidothioic acid methyl ester IUPAC Name: methyl N'-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-N-propan-2-ylcarbamimidothioate Traditional Name: 1-isopropyl-3-[[2-(4-methoxyphenyl)-1,3-dioxolan-2-yl]methyl]-2-methyl-isothiourea Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=NCC1(OCCO1)C2=CC=C(C=C2)OC)SC

Isomeric SMILES

CC(C)NC(=NCC1(OCCO1)C2=CC=C(C=C2)OC)SC

InChI

InChI=1S/C16H24N2O3S/c1-12(2)18-15(22-4)17-11-16(20-9-10-21-16)13-5-7-14(19-3)8-6-13/h5-8,12H,9-11H2,1-4H3,(H,17,18)