N-(4-butan-2-ylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(2-furylmethyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(2-furanylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(furan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(2-furfuryl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C20H27N3OS MolecularWeight: 357.51288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C20H27N3OS/c1-3-16(2)17-6-8-18(9-7-17)21-20(25)23-12-10-22(11-13-23)15-19-5-4-14-24-19/h4-9,14,16H,3,10-13,15H2,1-2H3,(H,21,25)