1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]propan-1-one CAS Name: 1-(4-phenyl-1-piperazinyl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]-1-propanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-phenylpiperazino)-2-[(1-phenyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)thio]propan-1-one Formula: C26H30N4OS MolecularWeight: 446.6076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NC4=C(N3C5=CC=CC=C5)CCCC4

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)SC3=NC4=C(N3C5=CC=CC=C5)CCCC4

InChI

InChI=1S/C26H30N4OS/c1-20(25(31)29-18-16-28(17-19-29)21-10-4-2-5-11-21)32-26-27-23-14-8-9-15-24(23)30(26)22-12-6-3-7-13-22/h2-7,10-13,20H,8-9,14-19H2,1H3