2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]acetamide CAS Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-N-[2-(4-ethyl-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N-[2-(4-ethylpiperazin-1-yl)phenyl]acetamide Traditional Name: 2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-N-[2-(4-ethylpiperazino)phenyl]acetamide Formula: C21H23ClN4O2S MolecularWeight: 430.95092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=CC=CC=C2NC(=O)CSC3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C21H23ClN4O2S/c1-2-25-9-11-26(12-10-25)18-6-4-3-5-16(18)23-20(27)14-29-21-24-17-13-15(22)7-8-19(17)28-21/h3-8,13H,2,9-12,14H2,1H3,(H,23,27)