2-chloranyl-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol

Systemtic Name: 2-chloranyl-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Openeye Name: 2-chloro-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol CAS Name: 2-chloro-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]-9-thioxanthenol IUPAC Name: 2-chloro-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Traditional Name: 2-chloro-9-[2-[5-(dimethylamino)pent-3-ynyl]-1,3-dithian-2-yl]thioxanthen-9-ol Formula: C24H26ClNOS3 MolecularWeight: 476.11734

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CCCC1(SCCCS1)C2(C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)O

Isomeric SMILES

CN(C)CC#CCCC1(SCCCS1)C2(C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)O

InChI

InChI=1S/C24H26ClNOS3/c1-26(2)14-7-3-6-13-23(28-15-8-16-29-23)24(27)19-9-4-5-10-21(19)30-22-12-11-18(25)17-20(22)24/h4-5,9-12,17,27H,6,8,13-16H2,1-2H3