7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide

Systemtic Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Openeye Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1-(2-methylthiazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide CAS Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(4-oxanyl)amino]methyl]phenyl]-1-(2-methyl-4-thiazolyl)-2,3-dihydro-1-benzazepine-4-carboxamide IUPAC Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(oxan-4-yl)amino]methyl]phenyl]-1-(2-methyl-1,3-thiazol-4-yl)-2,3-dihydro-1-benzazepine-4-carboxamide Traditional Name: 7-[4-(2-butoxyethoxy)phenyl]-N-[4-[[methyl(tetrahydropyran-4-yl)amino]methyl]phenyl]-1-(2-methylthiazol-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)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)C6=CSC(=N6)C

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCC(=C3)C(=O)NC4=CC=C(C=C4)CN(C)C5CCOCC5)C6=CSC(=N6)C

InChI

InChI=1S/C40H48N4O4S/c1-4-5-20-46-23-24-48-37-13-8-31(9-14-37)32-10-15-38-34(25-32)26-33(16-19-44(38)39-28-49-29(2)41-39)40(45)42-35-11-6-30(7-12-35)27-43(3)36-17-21-47-22-18-36/h6-15,25-26,28,36H,4-5,16-24,27H2,1-3H3,(H,42,45)