2-(3-methylquinoxalin-2-yl)sulfanyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(3-methylquinoxalin-2-yl)sulfanyl-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]ethanamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-methylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: 2-[(3-methyl-2-quinoxalinyl)thio]-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]acetamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(3-methylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-[(3-methylquinoxalin-2-yl)thio]acetamide Formula: C28H29N5OS MolecularWeight: 483.62776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H29N5OS/c1-21-28(31-26-10-6-5-9-25(26)29-21)35-20-27(34)30-23-11-13-24(14-12-23)33-17-15-32(16-18-33)19-22-7-3-2-4-8-22/h2-14H,15-20H2,1H3,(H,30,34)