N-[(2S)-5-[[2-(2-hydroxyethyloxy)phenyl]methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide

Systemtic Name: N-[(2S)-5-[[2-(2-hydroxyethyloxy)phenyl]methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxidanylidene-pentan-2-yl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide Openeye Name: N-[(1S)-4-[[2-(2-hydroxyethoxy)phenyl]methylamino]-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide CAS Name: N-[(2S)-5-[[2-(2-hydroxyethoxy)phenyl]methylamino]-1-[1-(1-naphthalenyl)ethylamino]-1-oxopentan-2-yl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide IUPAC Name: N-[(2S)-5-[[2-(2-hydroxyethoxy)phenyl]methylamino]-1-(1-naphthalen-1-ylethylamino)-1-oxopentan-2-yl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide Traditional Name: N-[(1S)-4-[[2-(2-hydroxyethoxy)benzyl]amino]-1-[1-(1-naphthyl)ethylcarbamoyl]butyl]-4-[(1H-imidazol-2-ylmethylamino)methyl]benzamide Formula: C38H44N6O4 MolecularWeight: 648.79376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C(CCCNCC3=CC=CC=C3OCCO)NC(=O)C4=CC=C(C=C4)CNCC5=NC=CN5

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)[C@H](CCCNCC3=CC=CC=C3OCCO)NC(=O)C4=CC=C(C=C4)CNCC5=NC=CN5

InChI

InChI=1S/C38H44N6O4/c1-27(32-12-6-10-29-8-2-4-11-33(29)32)43-38(47)34(13-7-19-39-25-31-9-3-5-14-35(31)48-23-22-45)44-37(46)30-17-15-28(16-18-30)24-40-26-36-41-20-21-42-36/h2-6,8-12,14-18,20-21,27,34,39-40,45H,7,13,19,22-26H2,1H3,(H,41,42)(H,43,47)(H,44,46)/t27?,34-/m0/s1