3-piperidin-1-ylsulfonyl-N-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)amino]benzamide

Systemtic Name: 3-piperidin-1-ylsulfonyl-N-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)amino]benzamide Openeye Name: 3-(1-piperidylsulfonyl)-N-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)amino]benzamide CAS Name: 3-(1-piperidinylsulfonyl)-N-[(E)-(3,5,5-trimethyl-1-cyclohex-2-enylidene)amino]benzamide IUPAC Name: 3-piperidin-1-ylsulfonyl-N-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)amino]benzamide Traditional Name: 3-piperidinosulfonyl-N-[(E)-(3,5,5-trimethylcyclohex-2-en-1-ylidene)amino]benzamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)CC(C1)(C)C

Isomeric SMILES

CC1=C/C(=N/NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)/CC(C1)(C)C

InChI

InChI=1S/C21H29N3O3S/c1-16-12-18(15-21(2,3)14-16)22-23-20(25)17-8-7-9-19(13-17)28(26,27)24-10-5-4-6-11-24/h7-9,12-13H,4-6,10-11,14-15H2,1-3H3,(H,23,25)/b22-18-