N-(2-dimethylaminoethyl)-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]cyclopentanecarboxamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]cyclopentanecarboxamide Openeye Name: N-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-N-(2-dimethylaminoethyl)cyclopentanecarboxamide CAS Name: N-(2-dimethylaminoethyl)-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]cyclopentanecarboxamide IUPAC Name: N-[[2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl]-N-(2-dimethylaminoethyl)cyclopentanecarboxamide Traditional Name: N-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-N-(2-dimethylaminoethyl)cyclopentanecarboxamide Formula: C25H38N4O3S MolecularWeight: 474.65922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(CCN(C)C)C(=O)C3CCCC3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(CCN(C)C)C(=O)C3CCCC3

InChI

InChI=1S/C25H38N4O3S/c1-20(2)17-29-23(16-26-25(29)33(31,32)19-21-10-6-5-7-11-21)18-28(15-14-27(3)4)24(30)22-12-8-9-13-22/h5-7,10-11,16,20,22H,8-9,12-15,17-19H2,1-4H3