N-[2-[4-(4-ethoxyphenyl)carbonylpiperazin-1-yl]-1-(4-fluorophenyl)sulfonyl-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(4-ethoxyphenyl)carbonylpiperazin-1-yl]-1-(4-fluorophenyl)sulfonyl-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-(4-ethoxybenzoyl)piperazin-1-yl]-1-(4-fluorophenyl)sulfonyl-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[4-[(4-ethoxyphenyl)-oxomethyl]-1-piperazinyl]-1-(4-fluorophenyl)sulfonyl-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(4-ethoxybenzoyl)piperazin-1-yl]-1-(4-fluorophenyl)sulfonyl-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(4-ethoxybenzoyl)piperazino]-1-(4-fluorophenyl)sulfonyl-2-keto-ethyl]thiophene-2-carboxamide Formula: C26H26FN3O6S2 MolecularWeight: 559.629543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C(NC(=O)C3=CC=CS3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H26FN3O6S2/c1-2-36-20-9-5-18(6-10-20)25(32)29-13-15-30(16-14-29)26(33)24(28-23(31)22-4-3-17-37-22)38(34,35)21-11-7-19(27)8-12-21/h3-12,17,24H,2,13-16H2,1H3,(H,28,31)