(2S)-6-azanyl-N-[(2S)-5-[bis(azanyl)methylideneamino]-1-(ethylamino)-1-oxidanylidene-pentan-2-yl]-2-(diethanoylamino)hexanamide

Systemtic Name: (2S)-6-azanyl-N-[(2S)-5-[bis(azanyl)methylideneamino]-1-(ethylamino)-1-oxidanylidene-pentan-2-yl]-2-(diethanoylamino)hexanamide Openeye Name: (2S)-6-amino-2-(diacetylamino)-N-[(1S)-1-(ethylcarbamoyl)-4-guanidino-butyl]hexanamide CAS Name: (2S)-6-amino-2-(diacetylamino)-N-[(2S)-5-(diaminomethylideneamino)-1-(ethylamino)-1-oxopentan-2-yl]hexanamide IUPAC Name: (2S)-6-amino-2-(diacetylamino)-N-[(2S)-5-(diaminomethylideneamino)-1-(ethylamino)-1-oxopentan-2-yl]hexanamide Traditional Name: (2S)-6-amino-2-(diacetylamino)-N-[(1S)-1-(ethylcarbamoyl)-4-guanidino-butyl]hexanamide Formula: C18H35N7O4 MolecularWeight: 413.515

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(CCCN=C(N)N)NC(=O)C(CCCCN)N(C(=O)C)C(=O)C

Isomeric SMILES

CCNC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)N(C(=O)C)C(=O)C

InChI

InChI=1S/C18H35N7O4/c1-4-22-16(28)14(8-7-11-23-18(20)21)24-17(29)15(9-5-6-10-19)25(12(2)26)13(3)27/h14-15H,4-11,19H2,1-3H3,(H,22,28)(H,24,29)(H4,20,21,23)/t14-,15-/m0/s1