2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]ethanamide

Systemtic Name: 2-(1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[3-[4-(phenylmethyl)piperazin-1-yl]propyl]ethanamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-[(1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: 2-[(1-methyl-2-oxo-4-quinolinyl)thio]-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]acetamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-2-(1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[3-(4-benzylpiperazino)propyl]-2-[(2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N4O2S/c1-28-23-11-6-5-10-22(23)24(18-26(28)32)33-20-25(31)27-12-7-13-29-14-16-30(17-15-29)19-21-8-3-2-4-9-21/h2-6,8-11,18H,7,12-17,19-20H2,1H3,(H,27,31)