(2S)-4-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2S)-4-[(1-ethyl-5-morpholin-4-ylsulfonyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2S)-4-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2S)-4-[[1-ethyl-5-(4-morpholinylsulfonyl)-2-benzimidazolyl]methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2S)-4-[(1-ethyl-5-morpholin-4-ylsulfonylbenzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2S)-4-[(1-ethyl-5-morpholinosulfonyl-benzimidazol-2-yl)methyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4CC(OC5=CC=CC=C54)C(=O)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CN4C[C@H](OC5=CC=CC=C54)C(=O)N

InChI

InChI=1S/C23H27N5O5S/c1-2-28-18-8-7-16(34(30,31)27-9-11-32-12-10-27)13-17(18)25-22(28)15-26-14-21(23(24)29)33-20-6-4-3-5-19(20)26/h3-8,13,21H,2,9-12,14-15H2,1H3,(H2,24,29)/t21-/m0/s1