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

Systemtic Name: S-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate Openeye Name: S-[[4-(3-bromophenyl)thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate CAS Name: 4-(4-fluorophenyl)-1-piperazinecarbothioic acid S-[[4-(3-bromophenyl)-2-thiazolyl]amino] ester IUPAC Name: S-[[4-(3-bromophenyl)-1,3-thiazol-2-yl]amino] 4-(4-fluorophenyl)piperazine-1-carbothioate Traditional Name: 4-(4-fluorophenyl)piperazine-1-carbothioic acid S-[[4-(3-bromophenyl)thiazol-2-yl]amino] ester Formula: C20H18BrFN4OS2 MolecularWeight: 493.415523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)SNC3=NC(=CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)SNC3=NC(=CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H18BrFN4OS2/c21-15-3-1-2-14(12-15)18-13-28-19(23-18)24-29-20(27)26-10-8-25(9-11-26)17-6-4-16(22)5-7-17/h1-7,12-13H,8-11H2,(H,23,24)