N-[1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]-4-methyl-2-[4-[4-(5-morpholin-4-yl-1H-pyrrol-2-yl)phenyl]phenyl]pentanamide

Systemtic Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]-4-methyl-2-[4-[4-(5-morpholin-4-yl-1H-pyrrol-2-yl)phenyl]phenyl]pentanamide Openeye Name: N-[1-(1,3-benzoxazole-2-carbonyl)butyl]-4-methyl-2-[4-[4-(5-morpholino-1H-pyrrol-2-yl)phenyl]phenyl]pentanamide CAS Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]-4-methyl-2-[4-[4-[5-(4-morpholinyl)-1H-pyrrol-2-yl]phenyl]phenyl]pentanamide IUPAC Name: N-[1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]-4-methyl-2-[4-[4-(5-morpholin-4-yl-1H-pyrrol-2-yl)phenyl]phenyl]pentanamide Traditional Name: N-[1-(1,3-benzoxazole-2-carbonyl)butyl]-4-methyl-2-[4-[4-(5-morpholino-1H-pyrrol-2-yl)phenyl]phenyl]valeramide Formula: C38H42N4O4 MolecularWeight: 618.76448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(CC(C)C)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=C(N5)N6CCOCC6

Isomeric SMILES

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(CC(C)C)C3=CC=C(C=C3)C4=CC=C(C=C4)C5=CC=C(N5)N6CCOCC6

InChI

InChI=1S/C38H42N4O4/c1-4-7-33(36(43)38-41-32-8-5-6-9-34(32)46-38)40-37(44)30(24-25(2)3)28-14-10-26(11-15-28)27-12-16-29(17-13-27)31-18-19-35(39-31)42-20-22-45-23-21-42/h5-6,8-19,25,30,33,39H,4,7,20-24H2,1-3H3,(H,40,44)