4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[4-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-[4-(methylthio)-1,3-benzothiazol-2-yl]piperazine-1-carbonyl]benzonitrile Formula: C20H18N4OS2 MolecularWeight: 394.51312

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H18N4OS2/c1-26-16-3-2-4-17-18(16)22-20(27-17)24-11-9-23(10-12-24)19(25)15-7-5-14(13-21)6-8-15/h2-8H,9-12H2,1H3