(2R)-2-(3-azanylpropanoylamino)-N-[(2R)-1-[[(2S)-1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-naphthalen-2-yl-propanamide

Systemtic Name: (2R)-2-(3-azanylpropanoylamino)-N-[(2R)-1-[[(2S)-1-(3-azanylpropylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]amino]-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-naphthalen-2-yl-propanamide Openeye Name: (2R)-2-(3-aminopropanoylamino)-N-[(1R)-2-[[(1S)-2-(3-aminopropylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]amino]-1-(2-naphthylmethyl)-2-oxo-ethyl]-3-(2-naphthyl)propanamide CAS Name: (2R)-2-[(3-amino-1-oxopropyl)amino]-N-[(2R)-1-[[(2S)-1-(3-aminopropylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]amino]-3-(2-naphthalenyl)-1-oxopropan-2-yl]-3-(2-naphthalenyl)propanamide IUPAC Name: (2R)-2-(3-aminopropanoylamino)-N-[(2R)-1-[[(2S)-1-(3-aminopropylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]amino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-3-naphthalen-2-ylpropanamide Traditional Name: (2R)-2-(3-aminopropanoylamino)-N-[(1R)-2-[[(1S)-2-(3-aminopropylamino)-2-keto-1-(2-naphthylmethyl)ethyl]amino]-2-keto-1-(2-naphthylmethyl)ethyl]-3-(2-naphthyl)propionamide Formula: C45H48N6O4 MolecularWeight: 736.90042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)NC(CC3=CC4=CC=CC=C4C=C3)C(=O)NC(CC5=CC6=CC=CC=C6C=C5)C(=O)NCCCN)NC(=O)CCN

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C[C@H](C(=O)N[C@H](CC3=CC4=CC=CC=C4C=C3)C(=O)N[C@@H](CC5=CC6=CC=CC=C6C=C5)C(=O)NCCCN)NC(=O)CCN

InChI

InChI=1S/C45H48N6O4/c46-21-7-23-48-43(53)39(27-30-14-17-33-8-1-4-11-36(33)24-30)50-45(55)41(29-32-16-19-35-10-3-6-13-38(35)26-32)51-44(54)40(49-42(52)20-22-47)28-31-15-18-34-9-2-5-12-37(34)25-31/h1-6,8-19,24-26,39-41H,7,20-23,27-29,46-47H2,(H,48,53)(H,49,52)(H,50,55)(H,51,54)/t39-,40+,41+/m0/s1