(3,4-dichlorophenyl)-[4-(3-phenyl-1-benzothiophen-4-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-dichlorophenyl)-[4-(3-phenyl-1-benzothiophen-4-yl)piperazin-1-yl]methanone Openeye Name: (3,4-dichlorophenyl)-[4-(3-phenylbenzothiophen-4-yl)piperazin-1-yl]methanone CAS Name: (3,4-dichlorophenyl)-[4-(3-phenyl-1-benzothiophen-4-yl)-1-piperazinyl]methanone IUPAC Name: (3,4-dichlorophenyl)-[4-(3-phenyl-1-benzothiophen-4-yl)piperazin-1-yl]methanone Traditional Name: (3,4-dichlorophenyl)-[4-(3-phenylbenzothiophen-4-yl)piperazino]methanone Formula: C25H20Cl2N2OS MolecularWeight: 467.4101

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C(=CC=C2)SC=C3C4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C3C(=CC=C2)SC=C3C4=CC=CC=C4)C(=O)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C25H20Cl2N2OS/c26-20-10-9-18(15-21(20)27)25(30)29-13-11-28(12-14-29)22-7-4-8-23-24(22)19(16-31-23)17-5-2-1-3-6-17/h1-10,15-16H,11-14H2