4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[4-(4-chlorophenyl)thiazol-2-yl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[4-(4-chlorophenyl)-2-thiazolyl]-N-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[4-(4-chlorophenyl)thiazol-2-yl]-N-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C21H21ClN4OS2 MolecularWeight: 445.00064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4OS2/c1-27-18-8-6-17(7-9-18)23-20(28)25-10-12-26(13-11-25)21-24-19(14-29-21)15-2-4-16(22)5-3-15/h2-9,14H,10-13H2,1H3,(H,23,28)