(6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone Openeye Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone CAS Name: [6-methoxy-3-(phenylthio)-1H-indol-2-yl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-(4-phenylpiperazin-1-yl)methanone Traditional Name: [6-methoxy-3-(phenylthio)-1H-indol-2-yl]-(4-phenylpiperazino)methanone Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(N2)C(=O)N3CCN(CC3)C4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(N2)C(=O)N3CCN(CC3)C4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O2S/c1-31-20-12-13-22-23(18-20)27-24(25(22)32-21-10-6-3-7-11-21)26(30)29-16-14-28(15-17-29)19-8-4-2-5-9-19/h2-13,18,27H,14-17H2,1H3