1-[(9E)-7-chloranyl-9-[3-(dimethylamino)-2-methyl-propylidene]thioxanthen-2-yl]propan-1-one

Systemtic Name: 1-[(9E)-7-chloranyl-9-[3-(dimethylamino)-2-methyl-propylidene]thioxanthen-2-yl]propan-1-one Openeye Name: 1-[(9E)-7-chloro-9-[3-(dimethylamino)-2-methyl-propylidene]thioxanthen-2-yl]propan-1-one CAS Name: 1-[(9E)-7-chloro-9-[3-(dimethylamino)-2-methylpropylidene]-2-thioxanthenyl]-1-propanone IUPAC Name: 1-[(9E)-7-chloro-9-[3-(dimethylamino)-2-methylpropylidene]thioxanthen-2-yl]propan-1-one Traditional Name: 1-[(9E)-7-chloro-9-[3-(dimethylamino)-2-methyl-propylidene]thioxanthen-2-yl]propan-1-one Formula: C22H24ClNOS MolecularWeight: 385.95006

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)SC3=C(C2=CC(C)CN(C)C)C=C(C=C3)Cl

Isomeric SMILES

CCC(=O)C1=CC\2=C(C=C1)SC3=C(/C2=C/C(C)CN(C)C)C=C(C=C3)Cl

InChI

InChI=1S/C22H24ClNOS/c1-5-20(25)15-6-8-21-18(11-15)17(10-14(2)13-24(3)4)19-12-16(23)7-9-22(19)26-21/h6-12,14H,5,13H2,1-4H3/b17-10+