N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[4-(1,1-dimethylpropyl)cyclohexylidene]amino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[4-(2-methylbutan-2-yl)cyclohexylidene]amino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(4-tert-amylcyclohexylidene)amino]-3-pyrrolidinosulfonyl-benzamide Formula: C22H33N3O3S MolecularWeight: 419.58072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)CC1

Isomeric SMILES

CCC(C)(C)C1CCC(=NNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)CC1

InChI

InChI=1S/C22H33N3O3S/c1-4-22(2,3)18-10-12-19(13-11-18)23-24-21(26)17-8-7-9-20(16-17)29(27,28)25-14-5-6-15-25/h7-9,16,18H,4-6,10-15H2,1-3H3,(H,24,26)