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

Systemtic Name: N-(furan-2-ylmethyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-(4-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Formula: C16H19N3O2S MolecularWeight: 317.40596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)O)C(=S)NCC3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)O)C(=S)NCC3=CC=CO3

InChI

InChI=1S/C16H19N3O2S/c20-14-5-3-13(4-6-14)18-7-9-19(10-8-18)16(22)17-12-15-2-1-11-21-15/h1-6,11,20H,7-10,12H2,(H,17,22)