N-(3,4-dimethoxyphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-(3,4-dimethoxyphenyl)-4-(furan-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-(3,4-dimethoxyphenyl)-4-[2-furanyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3,4-dimethoxyphenyl)-4-(furan-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-(3,4-dimethoxyphenyl)-4-(2-furoyl)piperazine-1-carbothioamide Formula: C18H21N3O4S MolecularWeight: 375.44204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3)OC

InChI

InChI=1S/C18H21N3O4S/c1-23-14-6-5-13(12-16(14)24-2)19-18(26)21-9-7-20(8-10-21)17(22)15-4-3-11-25-15/h3-6,11-12H,7-10H2,1-2H3,(H,19,26)