2-(1-butylsulfonylpyrrolidin-2-yl)-5-(2-methylphenyl)-1,3-benzoxazole

Systemtic Name: 2-(1-butylsulfonylpyrrolidin-2-yl)-5-(2-methylphenyl)-1,3-benzoxazole Openeye Name: 2-(1-butylsulfonylpyrrolidin-2-yl)-5-(o-tolyl)-1,3-benzoxazole CAS Name: 2-(1-butylsulfonyl-2-pyrrolidinyl)-5-(2-methylphenyl)-1,3-benzoxazole IUPAC Name: 2-(1-butylsulfonylpyrrolidin-2-yl)-5-(2-methylphenyl)-1,3-benzoxazole Traditional Name: 2-(1-butylsulfonylpyrrolidin-2-yl)-5-(o-tolyl)-1,3-benzoxazole Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1CCCC1C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4C

Isomeric SMILES

CCCCS(=O)(=O)N1CCCC1C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4C

InChI

InChI=1S/C22H26N2O3S/c1-3-4-14-28(25,26)24-13-7-10-20(24)22-23-19-15-17(11-12-21(19)27-22)18-9-6-5-8-16(18)2/h5-6,8-9,11-12,15,20H,3-4,7,10,13-14H2,1-2H3