3-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one

Systemtic Name: 3-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]piperazin-1-yl]carbonyl-8-methoxy-chromen-2-one Openeye Name: 3-[4-[[4-(4-fluorophenyl)thiazol-2-yl]methyl]piperazine-1-carbonyl]-8-methoxy-chromen-2-one CAS Name: 3-[[4-[[4-(4-fluorophenyl)-2-thiazolyl]methyl]-1-piperazinyl]-oxomethyl]-8-methoxy-1-benzopyran-2-one IUPAC Name: 3-[4-[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]piperazine-1-carbonyl]-8-methoxychromen-2-one Traditional Name: 3-[4-[[4-(4-fluorophenyl)thiazol-2-yl]methyl]piperazine-1-carbonyl]-8-methoxy-coumarin Formula: C25H22FN3O4S MolecularWeight: 479.523283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)CC4=NC(=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N3CCN(CC3)CC4=NC(=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C25H22FN3O4S/c1-32-21-4-2-3-17-13-19(25(31)33-23(17)21)24(30)29-11-9-28(10-12-29)14-22-27-20(15-34-22)16-5-7-18(26)8-6-16/h2-8,13,15H,9-12,14H2,1H3