S-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate

Systemtic Name: S-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate Openeye Name: S-[[4-(4-methoxyphenyl)thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate CAS Name: 4-(4-fluorophenyl)-1-piperazinecarbothioic acid S-[[4-(4-methoxyphenyl)-2-thiazolyl]amino] ester IUPAC Name: S-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate Traditional Name: 4-(4-fluorophenyl)piperazine-1-carbothioic acid S-[[4-(4-methoxyphenyl)thiazol-2-yl]amino] ester Formula: C21H21FN4O2S2 MolecularWeight: 444.545443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NSC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NSC(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O2S2/c1-28-18-8-2-15(3-9-18)19-14-29-20(23-19)24-30-21(27)26-12-10-25(11-13-26)17-6-4-16(22)5-7-17/h2-9,14H,10-13H2,1H3,(H,23,24)