2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[3-chloro-2-(4-methyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-[3-chloro-2-(4-methylpiperazino)phenyl]acetamide Formula: C20H21ClN4O2S MolecularWeight: 416.92434

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H21ClN4O2S/c1-24-9-11-25(12-10-24)19-14(21)5-4-7-16(19)22-18(26)13-28-20-23-15-6-2-3-8-17(15)27-20/h2-8H,9-13H2,1H3,(H,22,26)