3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfonyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfonyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 3-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-2-methylsulfonyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfonyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfonyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 3-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-2-mesyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C40H50N4O5S MolecularWeight: 698.9138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2C(N(C3=CC=CC=C3C=C2C(=O)N(C4=CC=CC=C4)C5=C(NC=N5)CCC)CC(C)C)S(=O)(=O)C

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2C(N(C3=CC=CC=C3C=C2C(=O)N(C4=CC=CC=C4)C5=C(NC=N5)CCC)CC(C)C)S(=O)(=O)C

InChI

InChI=1S/C40H50N4O5S/c1-6-8-23-48-24-25-49-33-21-19-30(20-22-33)37-34(26-31-15-12-13-18-36(31)43(27-29(3)4)40(37)50(5,46)47)39(45)44(32-16-10-9-11-17-32)38-35(14-7-2)41-28-42-38/h9-13,15-22,26,28-29,37,40H,6-8,14,23-25,27H2,1-5H3,(H,41,42)