2-[[4-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile

Systemtic Name: 2-[[4-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Openeye Name: 2-[[4-[(4-methylsulfonylpiperazin-1-yl)methyl]-2-pyridyl]amino]thiazole-5-carbonitrile CAS Name: 2-[[4-[(4-methylsulfonyl-1-piperazinyl)methyl]-2-pyridinyl]amino]-5-thiazolecarbonitrile IUPAC Name: 2-[[4-[(4-methylsulfonylpiperazin-1-yl)methyl]pyridin-2-yl]amino]-1,3-thiazole-5-carbonitrile Traditional Name: 2-[[4-[(4-mesylpiperazino)methyl]-2-pyridyl]amino]thiazole-5-carbonitrile Formula: C15H18N6O2S2 MolecularWeight: 378.47242

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC(=NC=C2)NC3=NC=C(S3)C#N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC(=NC=C2)NC3=NC=C(S3)C#N

InChI

InChI=1S/C15H18N6O2S2/c1-25(22,23)21-6-4-20(5-7-21)11-12-2-3-17-14(8-12)19-15-18-10-13(9-16)24-15/h2-3,8,10H,4-7,11H2,1H3,(H,17,18,19)