2-[4-[2-(cyclobutylmethoxy)-5-methylsulfonyl-phenyl]carbonylpiperazin-1-yl]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[4-[2-(cyclobutylmethoxy)-5-methylsulfonyl-phenyl]carbonylpiperazin-1-yl]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[4-[2-(cyclobutylmethoxy)-5-methylsulfonyl-benzoyl]piperazin-1-yl]thiazole-5-carbonitrile CAS Name: 2-[4-[[2-(cyclobutylmethoxy)-5-methylsulfonylphenyl]-oxomethyl]-1-piperazinyl]-5-thiazolecarbonitrile IUPAC Name: 2-[4-[2-(cyclobutylmethoxy)-5-methylsulfonylbenzoyl]piperazin-1-yl]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[4-[2-(cyclobutylmethoxy)-5-mesyl-benzoyl]piperazino]thiazole-5-carbonitrile Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CCC2)C(=O)N3CCN(CC3)C4=NC=C(S4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CCC2)C(=O)N3CCN(CC3)C4=NC=C(S4)C#N

InChI

InChI=1S/C21H24N4O4S2/c1-31(27,28)17-5-6-19(29-14-15-3-2-4-15)18(11-17)20(26)24-7-9-25(10-8-24)21-23-13-16(12-22)30-21/h5-6,11,13,15H,2-4,7-10,14H2,1H3