N-[(2S)-1-[[(2S)-6-azanyl-1-[[(2S)-5-[bis(azanyl)methylideneamino]-1-[[(2S)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-[[(2S)-6-azanyl-1-[[(2S)-5-[bis(azanyl)methylideneamino]-1-[[(2S)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]benzamide Openeye Name: N-[(1S)-1-[[(1S)-5-amino-1-[[(1S)-1-[[(1S)-1-formyl-2-(1H-indol-3-yl)ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]pentyl]carbamoyl]pentyl]benzamide CAS Name: N-[(2S)-1-[[(2S)-6-amino-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]benzamide IUPAC Name: N-[(2S)-1-[[(2S)-6-amino-1-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-1-(1H-indol-3-yl)-3-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]benzamide Traditional Name: N-[(1S)-1-[[(1S)-5-amino-1-[[(1S)-1-[[(1S)-1-formyl-2-(1H-indol-3-yl)ethyl]carbamoyl]-4-guanidino-butyl]carbamoyl]pentyl]carbamoyl]pentyl]benzamide Formula: C36H51N9O5 MolecularWeight: 689.84744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)NC(CCCCN)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC1=CNC2=CC=CC=C21)C=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C36H51N9O5/c1-2-3-15-29(43-32(47)24-12-5-4-6-13-24)34(49)44-30(17-9-10-19-37)35(50)45-31(18-11-20-40-36(38)39)33(48)42-26(23-46)21-25-22-41-28-16-8-7-14-27(25)28/h4-8,12-14,16,22-23,26,29-31,41H,2-3,9-11,15,17-21,37H2,1H3,(H,42,48)(H,43,47)(H,44,49)(H,45,50)(H4,38,39,40)/t26-,29-,30-,31-/m0/s1