N-(9-ethylcarbazol-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide

Systemtic Name: N-(9-ethylcarbazol-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Openeye Name: N-(9-ethylcarbazol-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide CAS Name: N-(9-ethyl-3-carbazolyl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide IUPAC Name: N-(9-ethylcarbazol-3-yl)-5-methylsulfonyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Traditional Name: N-(9-ethylcarbazol-3-yl)-5-mesyl-3,4-dihydro-2H-1,5-benzoxazepine-2-carboxamide Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3CCN(C4=CC=CC=C4O3)S(=O)(=O)C)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3CCN(C4=CC=CC=C4O3)S(=O)(=O)C)C5=CC=CC=C51

InChI

InChI=1S/C25H25N3O4S/c1-3-27-20-9-5-4-8-18(20)19-16-17(12-13-21(19)27)26-25(29)24-14-15-28(33(2,30)31)22-10-6-7-11-23(22)32-24/h4-13,16,24H,3,14-15H2,1-2H3,(H,26,29)