1-[(4E)-4-(2-chloranylthioxanthen-9-ylidene)butyl]piperazine hydrochloride

Systemtic Name: 1-[(4E)-4-(2-chloranylthioxanthen-9-ylidene)butyl]piperazine hydrochloride Openeye Name: 1-[(4E)-4-(2-chlorothioxanthen-9-ylidene)butyl]piperazine hydrochloride CAS Name: 1-[(4E)-4-(2-chloro-9-thioxanthenylidene)butyl]piperazine hydrochloride IUPAC Name: 1-[(4E)-4-(2-chlorothioxanthen-9-ylidene)butyl]piperazine hydrochloride Traditional Name: 1-[(4E)-4-(2-chlorothioxanthen-9-ylidene)butyl]piperazine hydrochloride Formula: C21H24Cl2N2S MolecularWeight: 407.39966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCC=C2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.Cl

Isomeric SMILES

C1CN(CCN1)CCC/C=C/2\C3=CC=CC=C3SC4=C2C=C(C=C4)Cl.Cl

InChI

InChI=1S/C21H23ClN2S.ClH/c22-16-8-9-21-19(15-16)17(18-6-1-2-7-20(18)25-21)5-3-4-12-24-13-10-23-11-14-24;/h1-2,5-9,15,23H,3-4,10-14H2;1H/b17-5+;