1-[4-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]carbothioylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]carbothioylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[5-(3-chloro-4-methyl-phenyl)furan-2-carbothioyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[5-(3-chloro-4-methylphenyl)-2-furanyl]-sulfanylidenemethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[5-(3-chloro-4-methylphenyl)furan-2-carbothioyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[5-(3-chloro-4-methyl-phenyl)furan-2-carbothioyl]piperazino]ethanone Formula: C18H19ClN2O2S MolecularWeight: 362.87366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)C(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)C(=O)C)Cl

InChI

InChI=1S/C18H19ClN2O2S/c1-12-3-4-14(11-15(12)19)16-5-6-17(23-16)18(24)21-9-7-20(8-10-21)13(2)22/h3-6,11H,7-10H2,1-2H3