4-[azanyl-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(naphthalen-1-ylmethyl)-4-oxidanylidene-N-phenethyl-butanamide

Systemtic Name: 4-[azanyl-[2-azanyl-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(naphthalen-1-ylmethyl)-4-oxidanylidene-N-phenethyl-butanamide Openeye Name: 4-[amino-[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(1-naphthylmethyl)-4-oxo-N-phenethyl-butanamide CAS Name: 4-[amino-[2-amino-3-(1H-imidazol-5-yl)-1-oxopropyl]amino]-3-(1-naphthalenylmethyl)-4-oxo-N-phenethylbutanamide IUPAC Name: 4-[amino-[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-(naphthalen-1-ylmethyl)-4-oxo-N-phenethylbutanamide Traditional Name: 4-[amino-[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-keto-3-(1-naphthylmethyl)-N-phenethyl-butyramide Formula: C29H32N6O3 MolecularWeight: 512.60278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)N(C(=O)C(CC4=CN=CN4)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CC(CC2=CC=CC3=CC=CC=C32)C(=O)N(C(=O)C(CC4=CN=CN4)N)N

InChI

InChI=1S/C29H32N6O3/c30-26(17-24-18-32-19-34-24)29(38)35(31)28(37)23(15-22-11-6-10-21-9-4-5-12-25(21)22)16-27(36)33-14-13-20-7-2-1-3-8-20/h1-12,18-19,23,26H,13-17,30-31H2,(H,32,34)(H,33,36)