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

Systemtic Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(cyclopropylmethyl)-2-methylsulfinyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(cyclopropylmethyl)-2-methylsulfinyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(cyclopropylmethyl)-2-methylsulfinyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(cyclopropylmethyl)-2-methylsulfinyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 3-[4-(2-butoxyethoxy)phenyl]-1-(cyclopropylmethyl)-2-methylsulfinyl-N-phenyl-N-(5-propyl-1H-imidazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Formula: C40H48N4O4S MolecularWeight: 680.89852

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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)CC6CC6)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)CC6CC6)S(=O)C

InChI

InChI=1S/C40H48N4O4S/c1-4-6-23-47-24-25-48-33-21-19-30(20-22-33)37-34(26-31-13-10-11-16-36(31)43(27-29-17-18-29)40(37)49(3)46)39(45)44(32-14-8-7-9-15-32)38-35(12-5-2)41-28-42-38/h7-11,13-16,19-22,26,28-29,37,40H,4-6,12,17-18,23-25,27H2,1-3H3,(H,41,42)