4-(furan-2-ylcarbonyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(furan-2-ylcarbonyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(furan-2-carbonyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[2-furanyl(oxo)methyl]-N-(2-methoxy-5-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(furan-2-carbonyl)-N-(2-methoxy-5-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-furoyl)-N-(2-methoxy-5-methyl-phenyl)piperazine-1-carbothioamide Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N3O3S/c1-13-5-6-15(23-2)14(12-13)19-18(25)21-9-7-20(8-10-21)17(22)16-4-3-11-24-16/h3-6,11-12H,7-10H2,1-2H3,(H,19,25)