(2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-N-[(2S)-1-[2-aminocarbonyl-2-(naphthalen-1-ylmethyl)hydrazinyl]-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-3-phenyl-propanamide

Systemtic Name: (2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-N-[(2S)-1-[2-aminocarbonyl-2-(naphthalen-1-ylmethyl)hydrazinyl]-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]-3-phenyl-propanamide Openeye Name: (2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-N-[(1S)-1-[[carbamoyl(1-naphthylmethyl)amino]carbamoyl]-4-guanidino-butyl]-3-phenyl-propanamide CAS Name: (2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-N-[(2S)-1-[2-carbamoyl-2-(1-naphthalenylmethyl)hydrazinyl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide IUPAC Name: (2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-N-[(2S)-1-[2-carbamoyl-2-(naphthalen-1-ylmethyl)hydrazinyl]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]-3-phenylpropanamide Traditional Name: (2R)-2-[[(2S)-2-acetamido-3-(1H-imidazol-5-yl)propanoyl]amino]-N-[(1S)-1-[[carbamoyl(1-naphthylmethyl)amino]carbamoyl]-4-guanidino-butyl]-3-phenyl-propionamide Formula: C35H43N11O5 MolecularWeight: 697.78662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CN=CN1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CCCN=C(N)N)C(=O)NN(CC3=CC=CC4=CC=CC=C43)C(=O)N

Isomeric SMILES

CC(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NN(CC3=CC=CC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C35H43N11O5/c1-22(47)42-30(18-26-19-39-21-41-26)32(49)44-29(17-23-9-3-2-4-10-23)31(48)43-28(15-8-16-40-34(36)37)33(50)45-46(35(38)51)20-25-13-7-12-24-11-5-6-14-27(24)25/h2-7,9-14,19,21,28-30H,8,15-18,20H2,1H3,(H2,38,51)(H,39,41)(H,42,47)(H,43,48)(H,44,49)(H,45,50)(H4,36,37,40)/t28-,29+,30-/m0/s1