2-[1-(phenylmethyl)indol-3-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[1-(phenylmethyl)indol-3-yl]sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(1-benzylindol-3-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(phenylmethyl)-3-indolyl]thio]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(1-benzylindol-3-yl)sulfanyl-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-benzylindol-3-yl)thio]-1-(4-phenylpiperazino)ethanone Formula: C27H27N3OS MolecularWeight: 441.58778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3OS/c31-27(29-17-15-28(16-18-29)23-11-5-2-6-12-23)21-32-26-20-30(19-22-9-3-1-4-10-22)25-14-8-7-13-24(25)26/h1-14,20H,15-19,21H2