4-[bis(4-fluorophenyl)methyl]-N-propan-2-yl-piperazine-1-carbothioamide

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-propan-2-yl-piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-isopropyl-piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-propan-2-yl-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-propan-2-ylpiperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-isopropyl-piperazine-1-carbothioamide Formula: C21H25F2N3S MolecularWeight: 389.505106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NC(=S)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25F2N3S/c1-15(2)24-21(27)26-13-11-25(12-14-26)20(16-3-7-18(22)8-4-16)17-5-9-19(23)10-6-17/h3-10,15,20H,11-14H2,1-2H3,(H,24,27)