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

Systemtic Name: N-(2-dimethylaminoethyl)-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]-2-phenyl-ethanamide Openeye Name: N-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-N-(2-dimethylaminoethyl)-2-phenyl-acetamide CAS Name: N-(2-dimethylaminoethyl)-N-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]-2-phenylacetamide IUPAC Name: N-[[2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl]-N-(2-dimethylaminoethyl)-2-phenylacetamide Traditional Name: N-[(2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl]-N-(2-dimethylaminoethyl)-2-phenyl-acetamide Formula: C27H36N4O3S MolecularWeight: 496.66474

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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)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)CN(CCN(C)C)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C27H36N4O3S/c1-22(2)19-31-25(18-28-27(31)35(33,34)21-24-13-9-6-10-14-24)20-30(16-15-29(3)4)26(32)17-23-11-7-5-8-12-23/h5-14,18,22H,15-17,19-21H2,1-4H3