2-[4-[(E)-3-(2-chloranyl-9H-thioxanthen-9-yl)prop-2-enyl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[(E)-3-(2-chloranyl-9H-thioxanthen-9-yl)prop-2-enyl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[(E)-3-(2-chloro-9H-thioxanthen-9-yl)allyl]piperazin-1-yl]ethanol CAS Name: 2-[4-[(E)-3-(2-chloro-9H-thioxanthen-9-yl)prop-2-enyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[(E)-3-(2-chloro-9H-thioxanthen-9-yl)prop-2-enyl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[(E)-3-(2-chloro-9H-thioxanthen-9-yl)allyl]piperazino]ethanol Formula: C22H25ClN2OS MolecularWeight: 400.9647

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CC=CC2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CCO)C/C=C/C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-8,16,18,26H,9-15H2/b5-3+