2-azanyl-5-(1-azanylethylideneamino)-N-[3-[3-[5-[[2-[2-(2-methoxyphenyl)ethanoylamino]-3-phenyl-propanoyl]amino]pentylamino]propylamino]propyl]pentanamide

Systemtic Name: 2-azanyl-5-(1-azanylethylideneamino)-N-[3-[3-[5-[[2-[2-(2-methoxyphenyl)ethanoylamino]-3-phenyl-propanoyl]amino]pentylamino]propylamino]propyl]pentanamide Openeye Name: 2-amino-5-(1-aminoethylideneamino)-N-[3-[3-[5-[[2-[[2-(2-methoxyphenyl)acetyl]amino]-3-phenyl-propanoyl]amino]pentylamino]propylamino]propyl]pentanamide CAS Name: 2-amino-5-(1-aminoethylideneamino)-N-[3-[3-[5-[[2-[[2-(2-methoxyphenyl)-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]amino]pentylamino]propylamino]propyl]pentanamide IUPAC Name: 2-amino-5-(1-aminoethylideneamino)-N-[3-[3-[5-[[2-[[2-(2-methoxyphenyl)acetyl]amino]-3-phenylpropanoyl]amino]pentylamino]propylamino]propyl]pentanamide Traditional Name: 2-amino-5-(1-aminoethylideneamino)-N-[3-[3-[5-[[2-[[2-(2-methoxyphenyl)acetyl]amino]-3-phenyl-propanoyl]amino]pentylamino]propylamino]propyl]valeramide Formula: C36H58N8O4 MolecularWeight: 666.89692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCCCC(C(=O)NCCCNCCCNCCCCCNC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CC=CC=C2OC)N)N

Isomeric SMILES

CC(=NCCCC(C(=O)NCCCNCCCNCCCCCNC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CC=CC=C2OC)N)N

InChI

InChI=1S/C36H58N8O4/c1-28(37)41-24-11-17-31(38)35(46)42-25-13-22-40-21-12-20-39-19-9-4-10-23-43-36(47)32(26-29-14-5-3-6-15-29)44-34(45)27-30-16-7-8-18-33(30)48-2/h3,5-8,14-16,18,31-32,39-40H,4,9-13,17,19-27,38H2,1-2H3,(H2,37,41)(H,42,46)(H,43,47)(H,44,45)