N-[1-[2-[[1-(2-aminocarbonylpyrrolidin-1-yl)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-[2-[[1-[1-(2-azanyl-4-methyl-pentanoyl)pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]ethanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-[2-[[1-(2-aminocarbonylpyrrolidin-1-yl)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]-1-[2-[[1-[1-(2-azanyl-4-methyl-pentanoyl)pyrrolidin-2-yl]carbonylpyrrolidin-2-yl]carbonylamino]ethanoyl]pyrrolidine-2-carboxamide Openeye Name: 1-[2-[[1-[1-(2-amino-4-methyl-pentanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]-N-[1-[2-[[1-(2-carbamoylpyrrolidine-1-carbonyl)-4-guanidino-butyl]carbamoyl]pyrrolidine-1-carbonyl]-3-methyl-butyl]pyrrolidine-2-carboxamide CAS Name: 1-[2-[[[1-[[1-(2-amino-4-methyl-1-oxopentyl)-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinyl]-oxomethyl]amino]-1-oxoethyl]-N-[1-[2-[[[1-(2-carbamoyl-1-pyrrolidinyl)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-oxomethyl]-1-pyrrolidinyl]-4-methyl-1-oxopentan-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 1-[2-[[1-[1-(2-amino-4-methylpentanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]-N-[1-[2-[[1-(2-carbamoylpyrrolidin-1-yl)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide Traditional Name: 1-[2-[[1-[1-(2-amino-4-methyl-pentanoyl)prolyl]prolyl]amino]acetyl]-N-[1-[2-[[1-(2-carbamoylpyrrolidine-1-carbonyl)-4-guanidino-butyl]carbamoyl]pyrrolidine-1-carbonyl]-3-methyl-butyl]pyrrolidine-2-carboxamide Formula: C45H75N13O9 MolecularWeight: 942.1587

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCC(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)N4CCCC4C(=O)NC(CCCN=C(N)N)C(=O)N5CCCC5C(=O)N)N

Isomeric SMILES

CC(C)CC(C(=O)N1CCCC1C(=O)N2CCCC2C(=O)NCC(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)N4CCCC4C(=O)NC(CCCN=C(N)N)C(=O)N5CCCC5C(=O)N)N

InChI

InChI=1S/C45H75N13O9/c1-26(2)23-28(46)41(64)58-22-10-16-35(58)44(67)57-21-8-13-32(57)38(61)51-25-36(59)54-18-7-14-33(54)39(62)53-30(24-27(3)4)43(66)56-20-9-15-34(56)40(63)52-29(11-5-17-50-45(48)49)42(65)55-19-6-12-31(55)37(47)60/h26-35H,5-25,46H2,1-4H3,(H2,47,60)(H,51,61)(H,52,63)(H,53,62)(H4,48,49,50)