1-[2,6-di(propan-2-yl)phenyl]-3-(3-ethanoylphenyl)sulfonyl-urea; 3-ethanoylbenzenesulfonamide

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-(3-ethanoylphenyl)sulfonyl-urea; 3-ethanoylbenzenesulfonamide Openeye Name: 3-acetylbenzenesulfonamide; 1-(3-acetylphenyl)sulfonyl-3-(2,6-diisopropylphenyl)urea CAS Name: 3-acetylbenzenesulfonamide; 1-(3-acetylphenyl)sulfonyl-3-[2,6-di(propan-2-yl)phenyl]urea IUPAC Name: 3-acetylbenzenesulfonamide; 1-(3-acetylphenyl)sulfonyl-3-[2,6-di(propan-2-yl)phenyl]urea Traditional Name: 3-acetylbenzenesulfonamide; 1-(3-acetylphenyl)sulfonyl-3-(2,6-diisopropylphenyl)urea Formula: C29H35N3O7S2 MolecularWeight: 601.7341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NS(=O)(=O)C2=CC=CC(=C2)C(=O)C.CC(=O)C1=CC(=CC=C1)S(=O)(=O)N

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)NS(=O)(=O)C2=CC=CC(=C2)C(=O)C.CC(=O)C1=CC(=CC=C1)S(=O)(=O)N

InChI

InChI=1S/C21H26N2O4S.C8H9NO3S/c1-13(2)18-10-7-11-19(14(3)4)20(18)22-21(25)23-28(26,27)17-9-6-8-16(12-17)15(5)24;1-6(10)7-3-2-4-8(5-7)13(9,11)12/h6-14H,1-5H3,(H2,22,23,25);2-5H,1H3,(H2,9,11,12)