2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanyl-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(3-morpholinoquinoxalin-2-yl)sulfanyl-ethanone CAS Name: 2-[[3-(4-morpholinyl)-2-quinoxalinyl]thio]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(3-morpholin-4-ylquinoxalin-2-yl)sulfanylethanone Traditional Name: 1-(4-benzylpiperazino)-2-[(3-morpholinoquinoxalin-2-yl)thio]ethanone Formula: C25H29N5O2S MolecularWeight: 463.59506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4N=C3N5CCOCC5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4N=C3N5CCOCC5

InChI

InChI=1S/C25H29N5O2S/c31-23(29-12-10-28(11-13-29)18-20-6-2-1-3-7-20)19-33-25-24(30-14-16-32-17-15-30)26-21-8-4-5-9-22(21)27-25/h1-9H,10-19H2