4-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazin-1-yl]carbonylpiperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazine-1-carbonyl]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[[4-[(3,5-dimethyl-4-isoxazolyl)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]piperazine-1-carbonyl]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[4-[(3,5-dimethylisoxazol-4-yl)methyl]piperazine-1-carbonyl]piperidino]sulfonylbenzonitrile Formula: C23H29N5O4S MolecularWeight: 471.57246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H29N5O4S/c1-17-22(18(2)32-25-17)16-26-11-13-27(14-12-26)23(29)20-7-9-28(10-8-20)33(30,31)21-5-3-19(15-24)4-6-21/h3-6,20H,7-14,16H2,1-2H3