3-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonylchromen-2-one

Systemtic Name: 3-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]carbonylchromen-2-one Openeye Name: 3-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]chromen-2-one CAS Name: 3-[[4-[[5-(3-fluorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-oxomethyl]-1-benzopyran-2-one IUPAC Name: 3-[4-[[5-(3-fluorophenyl)thiophen-2-yl]methyl]piperazine-1-carbonyl]chromen-2-one Traditional Name: 3-[4-[[5-(3-fluorophenyl)-2-thienyl]methyl]piperazine-1-carbonyl]coumarin Formula: C25H21FN2O3S MolecularWeight: 448.509243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)F)C(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)F)C(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H21FN2O3S/c26-19-6-3-5-18(14-19)23-9-8-20(32-23)16-27-10-12-28(13-11-27)24(29)21-15-17-4-1-2-7-22(17)31-25(21)30/h1-9,14-15H,10-13,16H2