5-[bis(azanyl)methylideneamino]-N-[3-naphthalen-2-yl-1-oxidanylidene-1-[(2-oxidanylidene-4-phenoxy-azetidin-3-yl)amino]propan-2-yl]pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-N-[3-naphthalen-2-yl-1-oxidanylidene-1-[(2-oxidanylidene-4-phenoxy-azetidin-3-yl)amino]propan-2-yl]pentanamide Openeye Name: 5-guanidino-N-[1-(2-naphthylmethyl)-2-oxo-2-[(2-oxo-4-phenoxy-azetidin-3-yl)amino]ethyl]pentanamide CAS Name: 5-(diaminomethylideneamino)-N-[3-(2-naphthalenyl)-1-oxo-1-[(2-oxo-4-phenoxy-3-azetidinyl)amino]propan-2-yl]pentanamide IUPAC Name: 5-(diaminomethylideneamino)-N-[3-naphthalen-2-yl-1-oxo-1-[(2-oxo-4-phenoxyazetidin-3-yl)amino]propan-2-yl]pentanamide Traditional Name: 5-guanidino-N-[2-keto-2-[(2-keto-4-phenoxy-azetidin-3-yl)amino]-1-(2-naphthylmethyl)ethyl]valeramide Formula: C28H32N6O4 MolecularWeight: 516.59148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2C(C(=O)N2)NC(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)CCCCN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)OC2C(C(=O)N2)NC(=O)C(CC3=CC4=CC=CC=C4C=C3)NC(=O)CCCCN=C(N)N

InChI

InChI=1S/C28H32N6O4/c29-28(30)31-15-7-6-12-23(35)32-22(17-18-13-14-19-8-4-5-9-20(19)16-18)25(36)33-24-26(37)34-27(24)38-21-10-2-1-3-11-21/h1-5,8-11,13-14,16,22,24,27H,6-7,12,15,17H2,(H,32,35)(H,33,36)(H,34,37)(H4,29,30,31)