N-(5-chloranyl-2-methoxy-phenyl)-4-(4-cyanophenyl)piperazine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-(4-cyanophenyl)piperazine-1-carbothioamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-(4-cyanophenyl)piperazine-1-carbothioamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-(4-cyanophenyl)-1-piperazinecarbothioamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-(4-cyanophenyl)piperazine-1-carbothioamide Traditional Name: N-(5-chloro-2-methoxy-phenyl)-4-(4-cyanophenyl)piperazine-1-carbothioamide Formula: C19H19ClN4OS MolecularWeight: 386.89836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H19ClN4OS/c1-25-18-7-4-15(20)12-17(18)22-19(26)24-10-8-23(9-11-24)16-5-2-14(13-21)3-6-16/h2-7,12H,8-11H2,1H3,(H,22,26)