2-[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)thiophen-2-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)thiophen-2-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-[[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)-2-thienyl]sulfanyl]-1-phenyl-ethanone CAS Name: 2-[[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)-2-thiophenyl]thio]-1-phenylethanone IUPAC Name: 2-[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)thiophen-2-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[4-(2,2-diethyl-4-methyl-1,3-dioxan-4-yl)-2-thienyl]thio]-1-phenyl-ethanone Formula: C21H26O3S2 MolecularWeight: 390.55934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(OCCC(O1)(C)C2=CSC(=C2)SCC(=O)C3=CC=CC=C3)CC

Isomeric SMILES

CCC1(OCCC(O1)(C)C2=CSC(=C2)SCC(=O)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H26O3S2/c1-4-21(5-2)23-12-11-20(3,24-21)17-13-19(25-14-17)26-15-18(22)16-9-7-6-8-10-16/h6-10,13-14H,4-5,11-12,15H2,1-3H3