N-(3-fluoranyl-4-methyl-phenyl)-4-thiophen-2-ylcarbonyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-thiophen-2-ylcarbonyl-piperazine-1-carbothioamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-(thiophene-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-[oxo(thiophen-2-yl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-(thiophene-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-(2-thenoyl)piperazine-1-carbothioamide Formula: C17H18FN3OS2 MolecularWeight: 363.472723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CS3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CS3)F

InChI

InChI=1S/C17H18FN3OS2/c1-12-4-5-13(11-14(12)18)19-17(23)21-8-6-20(7-9-21)16(22)15-3-2-10-24-15/h2-5,10-11H,6-9H2,1H3,(H,19,23)