N-[3-[(1R)-2-[[4-[4-(4-dimethylaminophenyl)imidazol-1-yl]-2-methyl-butan-2-yl]amino]-1-oxidanyl-ethyl]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[(1R)-2-[[4-[4-(4-dimethylaminophenyl)imidazol-1-yl]-2-methyl-butan-2-yl]amino]-1-oxidanyl-ethyl]phenyl]benzenesulfonamide Openeye Name: N-[3-[(1R)-2-[[3-[4-(4-dimethylaminophenyl)imidazol-1-yl]-1,1-dimethyl-propyl]amino]-1-hydroxy-ethyl]phenyl]benzenesulfonamide CAS Name: N-[3-[(1R)-2-[[4-[4-(4-dimethylaminophenyl)-1-imidazolyl]-2-methylbutan-2-yl]amino]-1-hydroxyethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-[(1R)-2-[[4-[4-(4-dimethylaminophenyl)imidazol-1-yl]-2-methylbutan-2-yl]amino]-1-hydroxyethyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[(1R)-2-[[3-[4-(4-dimethylaminophenyl)imidazol-1-yl]-1,1-dimethyl-propyl]amino]-1-hydroxy-ethyl]phenyl]benzenesulfonamide Formula: C30H37N5O3S MolecularWeight: 547.71148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(N=C1)C2=CC=C(C=C2)N(C)C)NCC(C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(CCN1C=C(N=C1)C2=CC=C(C=C2)N(C)C)NC[C@@H](C3=CC(=CC=C3)NS(=O)(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C30H37N5O3S/c1-30(2,17-18-35-21-28(31-22-35)23-13-15-26(16-14-23)34(3)4)32-20-29(36)24-9-8-10-25(19-24)33-39(37,38)27-11-6-5-7-12-27/h5-16,19,21-22,29,32-33,36H,17-18,20H2,1-4H3/t29-/m0/s1