(4-azanylcyclohexyl)-[4-(2-chloranylthioxanthen-9-ylidene)piperidin-1-yl]methanone

Systemtic Name: (4-azanylcyclohexyl)-[4-(2-chloranylthioxanthen-9-ylidene)piperidin-1-yl]methanone Openeye Name: (4-aminocyclohexyl)-[4-(2-chlorothioxanthen-9-ylidene)-1-piperidyl]methanone CAS Name: (4-aminocyclohexyl)-[4-(2-chloro-9-thioxanthenylidene)-1-piperidinyl]methanone IUPAC Name: (4-aminocyclohexyl)-[4-(2-chlorothioxanthen-9-ylidene)piperidin-1-yl]methanone Traditional Name: (4-aminocyclohexyl)-[4-(2-chlorothioxanthen-9-ylidene)piperidino]methanone Formula: C25H27ClN2OS MolecularWeight: 439.01268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)N2CCC(=C3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl)CC2)N

Isomeric SMILES

C1CC(CCC1C(=O)N2CCC(=C3C4=CC=CC=C4SC5=C3C=C(C=C5)Cl)CC2)N

InChI

InChI=1S/C25H27ClN2OS/c26-18-7-10-23-21(15-18)24(20-3-1-2-4-22(20)30-23)16-11-13-28(14-12-16)25(29)17-5-8-19(27)9-6-17/h1-4,7,10,15,17,19H,5-6,8-9,11-14,27H2