4-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(2,4-dimethylphenyl)-N-(2-furylmethyl)piperazine-1-carbothioamide CAS Name: 4-(2,4-dimethylphenyl)-N-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,4-dimethylphenyl)-N-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(2,4-dimethylphenyl)-N-(2-furfuryl)piperazine-1-carbothioamide Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCC3=CC=CO3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=S)NCC3=CC=CO3)C

InChI

InChI=1S/C18H23N3OS/c1-14-5-6-17(15(2)12-14)20-7-9-21(10-8-20)18(23)19-13-16-4-3-11-22-16/h3-6,11-12H,7-10,13H2,1-2H3,(H,19,23)