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

Systemtic Name: 2-[4-[2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]carbonylpiperazin-1-yl]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[4-[2-(cyclopropylmethoxy)-5-methylsulfonyl-benzoyl]piperazin-1-yl]thiazole-5-carbonitrile CAS Name: 2-[4-[[2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]-oxomethyl]-1-piperazinyl]-5-thiazolecarbonitrile IUPAC Name: 2-[4-[2-(cyclopropylmethoxy)-5-methylsulfonylbenzoyl]piperazin-1-yl]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[4-[2-(cyclopropylmethoxy)-5-mesyl-benzoyl]piperazino]thiazole-5-carbonitrile Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=NC=C(S4)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=NC=C(S4)C#N

InChI

InChI=1S/C20H22N4O4S2/c1-30(26,27)16-4-5-18(28-13-14-2-3-14)17(10-16)19(25)23-6-8-24(9-7-23)20-22-12-15(11-21)29-20/h4-5,10,12,14H,2-3,6-9,13H2,1H3