N-(4-cyano-2-methyl-pyrazol-3-yl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(4-cyano-2-methyl-3-pyrazolyl)-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(4-cyano-2-methylpyrazol-3-yl)-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(4-cyano-2-methyl-pyrazol-3-yl)-4-methyl-3-piperidinosulfonyl-benzamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=NN2C)C#N)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=NN2C)C#N)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H21N5O3S/c1-13-6-7-14(18(24)21-17-15(11-19)12-20-22(17)2)10-16(13)27(25,26)23-8-4-3-5-9-23/h6-7,10,12H,3-5,8-9H2,1-2H3,(H,21,24)