(E,2S)-5-azanyl-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-methyl-pent-3-enoic acid

Systemtic Name: (E,2S)-5-azanyl-2-[[(2S)-5-[bis(azanyl)methylideneamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-methyl-pent-3-enoic acid Openeye Name: (E,2S)-5-amino-2-[[(2S)-2-(tert-butoxycarbonylamino)-5-guanidino-pentanoyl]amino]-2-methyl-pent-3-enoic acid CAS Name: (E,2S)-5-amino-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-2-methyl-3-pentenoic acid IUPAC Name: (E,2S)-5-amino-2-[[(2S)-5-(diaminomethylideneamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]-2-methylpent-3-enoic acid Traditional Name: (E,2S)-5-amino-2-[[(2S)-2-(tert-butoxycarbonylamino)-5-guanidino-pentanoyl]amino]-2-methyl-pent-3-enoic acid Formula: C17H32N6O5 MolecularWeight: 400.47318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCN=C(N)N)C(=O)NC(C)(C=CCN)C(=O)O

Isomeric SMILES

C[C@](/C=C/CN)(C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H32N6O5/c1-16(2,3)28-15(27)22-11(7-5-10-21-14(19)20)12(24)23-17(4,13(25)26)8-6-9-18/h6,8,11H,5,7,9-10,18H2,1-4H3,(H,22,27)(H,23,24)(H,25,26)(H4,19,20,21)/b8-6+/t11-,17-/m0/s1