3-[[bis(2-methylpropyl)amino]methyl]-5-morpholin-4-ylsulfonyl-1,3-benzoxazole-2-thione

Systemtic Name: 3-[[bis(2-methylpropyl)amino]methyl]-5-morpholin-4-ylsulfonyl-1,3-benzoxazole-2-thione Openeye Name: 3-[(diisobutylamino)methyl]-5-morpholinosulfonyl-1,3-benzoxazole-2-thione CAS Name: 3-[[bis(2-methylpropyl)amino]methyl]-5-(4-morpholinylsulfonyl)-1,3-benzoxazole-2-thione IUPAC Name: 3-[[bis(2-methylpropyl)amino]methyl]-5-morpholin-4-ylsulfonyl-1,3-benzoxazole-2-thione Traditional Name: 3-[(diisobutylamino)methyl]-5-morpholinosulfonyl-1,3-benzoxazole-2-thione Formula: C20H31N3O4S2 MolecularWeight: 441.60784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC1=S

Isomeric SMILES

CC(C)CN(CC(C)C)CN1C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OC1=S

InChI

InChI=1S/C20H31N3O4S2/c1-15(2)12-21(13-16(3)4)14-23-18-11-17(5-6-19(18)27-20(23)28)29(24,25)22-7-9-26-10-8-22/h5-6,11,15-16H,7-10,12-14H2,1-4H3