N-[2-(4-fluorophenyl)ethyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carboxamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinecarboxamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-4-(5-methylthiophen-2-yl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-4-[(5-methyl-2-thienyl)sulfonyl]piperazine-1-carboxamide Formula: C18H22FN3O3S2 MolecularWeight: 411.513983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H22FN3O3S2/c1-14-2-7-17(26-14)27(24,25)22-12-10-21(11-13-22)18(23)20-9-8-15-3-5-16(19)6-4-15/h2-7H,8-13H2,1H3,(H,20,23)