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

Systemtic Name: 3-[4-[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]carbothioylpiperazin-1-yl]propanenitrile Openeye Name: 3-[4-[5-(3-chloro-4-methyl-phenyl)furan-2-carbothioyl]piperazin-1-yl]propanenitrile CAS Name: 3-[4-[[5-(3-chloro-4-methylphenyl)-2-furanyl]-sulfanylidenemethyl]-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-[5-(3-chloro-4-methylphenyl)furan-2-carbothioyl]piperazin-1-yl]propanenitrile Traditional Name: 3-[4-[5-(3-chloro-4-methyl-phenyl)furan-2-carbothioyl]piperazino]propionitrile Formula: C19H20ClN3OS MolecularWeight: 373.8996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)CCC#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C(=S)N3CCN(CC3)CCC#N)Cl

InChI

InChI=1S/C19H20ClN3OS/c1-14-3-4-15(13-16(14)20)17-5-6-18(24-17)19(25)23-11-9-22(10-12-23)8-2-7-21/h3-6,13H,2,8-12H2,1H3