(2S)-N-[5-[[(2S)-5-azanyl-1-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-1-oxidanylidene-pentan-2-yl]amino]pentyl]-2-[2-(1H-indol-3-yl)ethanoylamino]butanediamide

Systemtic Name: (2S)-N-[5-[[(2S)-5-azanyl-1-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]-1-oxidanylidene-pentan-2-yl]amino]pentyl]-2-[2-(1H-indol-3-yl)ethanoylamino]butanediamide Openeye Name: (2S)-N-[5-[[(1S)-4-amino-1-[[(2S)-2-amino-5-guanidino-pentanoyl]carbamoyl]butyl]amino]pentyl]-2-[[2-(1H-indol-3-yl)acetyl]amino]butanediamide CAS Name: (2S)-N-[5-[[(2S)-5-amino-1-[[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]-1-oxopentan-2-yl]amino]pentyl]-2-[[2-(1H-indol-3-yl)-1-oxoethyl]amino]butanediamide IUPAC Name: (2S)-N-[5-[[(2S)-5-amino-1-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-1-oxopentan-2-yl]amino]pentyl]-2-[[2-(1H-indol-3-yl)acetyl]amino]butanediamide Traditional Name: (2S)-N-[5-[[(1S)-4-amino-1-[[(2S)-2-amino-5-guanidino-pentanoyl]carbamoyl]butyl]amino]pentyl]-2-[[2-(1H-indol-3-yl)acetyl]amino]succinamide Formula: C30H49N11O5 MolecularWeight: 643.78076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(=O)NC(CC(=O)N)C(=O)NCCCCCNC(CCCN)C(=O)NC(=O)C(CCCN=C(N)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(=O)N[C@@H](CC(=O)N)C(=O)NCCCCCN[C@@H](CCCN)C(=O)NC(=O)[C@H](CCCN=C(N)N)N

InChI

InChI=1S/C30H49N11O5/c31-12-6-11-23(29(46)41-27(44)21(32)9-7-15-38-30(34)35)36-13-4-1-5-14-37-28(45)24(17-25(33)42)40-26(43)16-19-18-39-22-10-3-2-8-20(19)22/h2-3,8,10,18,21,23-24,36,39H,1,4-7,9,11-17,31-32H2,(H2,33,42)(H,37,45)(H,40,43)(H4,34,35,38)(H,41,44,46)/t21-,23-,24-/m0/s1