(2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-3-phenyl-propanoyl]amino]-5-[bis(azanyl)methylideneamino]-N-[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanylidenepropan-2-yl]amino]propan-2-yl]pentanamide

Systemtic Name: (2S)-2-[[(2S)-2-[[(2S)-2-azanylpropanoyl]amino]-3-phenyl-propanoyl]amino]-5-[bis(azanyl)methylideneamino]-N-[(2S)-1-oxidanylidene-1-[[(2S)-1-oxidanylidenepropan-2-yl]amino]propan-2-yl]pentanamide Openeye Name: (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenyl-propanoyl]amino]-5-guanidino-N-[(1S)-1-methyl-2-[[(1S)-1-methyl-2-oxo-ethyl]amino]-2-oxo-ethyl]pentanamide CAS Name: (2S)-2-[[(2S)-2-[[(2S)-2-amino-1-oxopropyl]amino]-1-oxo-3-phenylpropyl]amino]-5-(diaminomethylideneamino)-N-[(2S)-1-oxo-1-[[(2S)-1-oxopropan-2-yl]amino]propan-2-yl]pentanamide IUPAC Name: (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)-N-[(2S)-1-oxo-1-[[(2S)-1-oxopropan-2-yl]amino]propan-2-yl]pentanamide Traditional Name: (2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-phenyl-propanoyl]amino]-5-guanidino-N-[(1S)-2-keto-2-[[(1S)-2-keto-1-methyl-ethyl]amino]-1-methyl-ethyl]valeramide Formula: C24H38N8O5 MolecularWeight: 518.60912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C=O)NC(=O)C(C)NC(=O)C(CCCN=C(N)N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(C)N

Isomeric SMILES

C[C@@H](C=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)N

InChI

InChI=1S/C24H38N8O5/c1-14(13-33)29-21(35)16(3)30-22(36)18(10-7-11-28-24(26)27)31-23(37)19(32-20(34)15(2)25)12-17-8-5-4-6-9-17/h4-6,8-9,13-16,18-19H,7,10-12,25H2,1-3H3,(H,29,35)(H,30,36)(H,31,37)(H,32,34)(H4,26,27,28)/t14-,15-,16-,18-,19-/m0/s1