3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfinyl-N-phenyl-N-(4-propylimidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfinyl-N-phenyl-N-(4-propylimidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 3-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-2-methylsulfinyl-N-phenyl-N-(4-propylimidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfinyl-N-phenyl-N-(4-propyl-4-imidazolyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-2-methylsulfinyl-N-phenyl-N-(4-propylimidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 3-[4-(2-butoxyethoxy)phenyl]-1-isobutyl-2-methylsulfinyl-N-phenyl-N-(4-propylimidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C40H50N4O4S MolecularWeight: 682.9144

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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)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)C

InChI

InChI=1S/C40H50N4O4S/c1-6-8-23-47-24-25-48-34-20-18-31(19-21-34)37-35(26-32-14-12-13-17-36(32)43(27-30(3)4)39(37)49(5)46)38(45)44(33-15-10-9-11-16-33)40(22-7-2)28-41-29-42-40/h9-21,26,28-30,37,39H,6-8,22-25,27H2,1-5H3