4-[(4-ethanoylpiperazin-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 4-[(4-ethanoylpiperazin-1-yl)methyl]benzenecarbothioamide Openeye Name: 4-[(4-acetylpiperazin-1-yl)methyl]benzenecarbothioamide CAS Name: 4-[(4-acetyl-1-piperazinyl)methyl]benzenecarbothioamide IUPAC Name: 4-[(4-acetylpiperazin-1-yl)methyl]benzenecarbothioamide Traditional Name: 4-[(4-acetylpiperazino)methyl]thiobenzamide Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C14H19N3OS/c1-11(18)17-8-6-16(7-9-17)10-12-2-4-13(5-3-12)14(15)19/h2-5H,6-10H2,1H3,(H2,15,19)