3-acetamido-2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethanoylamino]-N-(naphthalen-1-ylmethyl)propanamide

Systemtic Name: 3-acetamido-2-[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]ethanoylamino]-N-(naphthalen-1-ylmethyl)propanamide Openeye Name: 3-acetamido-2-[[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]acetyl]amino]-N-(1-naphthylmethyl)propanamide CAS Name: 3-acetamido-2-[[2-[3-[(4-cyanophenyl)methyl]-4-imidazolyl]-1-oxoethyl]amino]-N-(1-naphthalenylmethyl)propanamide IUPAC Name: 3-acetamido-2-[[2-[3-[(4-cyanophenyl)methyl]imidazol-4-yl]acetyl]amino]-N-(naphthalen-1-ylmethyl)propanamide Traditional Name: 3-acetamido-2-[[2-[3-(4-cyanobenzyl)imidazol-4-yl]acetyl]amino]-N-(1-naphthylmethyl)propionamide Formula: C29H28N6O3 MolecularWeight: 508.57102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC(C(=O)NCC1=CC=CC2=CC=CC=C21)NC(=O)CC3=CN=CN3CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC(=O)NCC(C(=O)NCC1=CC=CC2=CC=CC=C21)NC(=O)CC3=CN=CN3CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C29H28N6O3/c1-20(36)32-17-27(29(38)33-15-24-7-4-6-23-5-2-3-8-26(23)24)34-28(37)13-25-16-31-19-35(25)18-22-11-9-21(14-30)10-12-22/h2-12,16,19,27H,13,15,17-18H2,1H3,(H,32,36)(H,33,38)(H,34,37)