4-(4,5-dimethylthiophen-2-yl)carbonyl-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(4,5-dimethylthiophen-2-yl)carbonyl-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-(4,5-dimethylthiophene-2-carbonyl)-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[(4,5-dimethyl-2-thiophenyl)-oxomethyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(4,5-dimethylthiophene-2-carbonyl)-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-(4,5-dimethylthiophene-2-carbonyl)-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C18H20FN3O2S MolecularWeight: 361.433703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=C(SC(=C1)C(=O)N2CCN(CC2)C(=O)NC3=CC=C(C=C3)F)C

InChI

InChI=1S/C18H20FN3O2S/c1-12-11-16(25-13(12)2)17(23)21-7-9-22(10-8-21)18(24)20-15-5-3-14(19)4-6-15/h3-6,11H,7-10H2,1-2H3,(H,20,24)