9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol

Systemtic Name: 9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Openeye Name: 9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol CAS Name: 9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]-9-thioxanthenol IUPAC Name: 9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Traditional Name: 9-[2-[5-[ethyl(methyl)amino]pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Formula: C25H29NOS3 MolecularWeight: 455.69886

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)CC#CCCC1(SCCCS1)C2(C3=CC=CC=C3SC4=CC=CC=C42)O

Isomeric SMILES

CCN(C)CC#CCCC1(SCCCS1)C2(C3=CC=CC=C3SC4=CC=CC=C42)O

InChI

InChI=1S/C25H29NOS3/c1-3-26(2)17-10-4-9-16-24(28-18-11-19-29-24)25(27)20-12-5-7-14-22(20)30-23-15-8-6-13-21(23)25/h5-8,12-15,27H,3,9,11,16-19H2,1-2H3