4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide Openeye Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide CAS Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-[4-(methylthio)phenyl]-1-piperazinecarboxamide IUPAC Name: 4-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-(4-methylsulfanylphenyl)piperazine-1-carboxamide Traditional Name: 4-(3-m-anisyl-1,2,4-thiadiazol-5-yl)-N-[4-(methylthio)phenyl]piperazine-1-carboxamide Formula: C22H25N5O2S2 MolecularWeight: 455.5962

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC=CC(=C1)CC2=NSC(=N2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C22H25N5O2S2/c1-29-18-5-3-4-16(14-18)15-20-24-22(31-25-20)27-12-10-26(11-13-27)21(28)23-17-6-8-19(30-2)9-7-17/h3-9,14H,10-13,15H2,1-2H3,(H,23,28)