4-(furan-2-ylmethyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(furan-2-ylmethyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2-furylmethyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(2-furanylmethyl)-N-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(furan-2-ylmethyl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-furfuryl)-N-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C17H21N3O2S MolecularWeight: 331.43254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CO3

InChI

InChI=1S/C17H21N3O2S/c1-21-15-6-4-14(5-7-15)18-17(23)20-10-8-19(9-11-20)13-16-3-2-12-22-16/h2-7,12H,8-11,13H2,1H3,(H,18,23)