6-[bis(azanyl)methylideneamino]-N-[3-cyclohexyl-1-oxidanylidene-1-[(2-oxidanylidene-4-phenoxy-azetidin-3-yl)amino]propan-2-yl]hexanamide

Systemtic Name: 6-[bis(azanyl)methylideneamino]-N-[3-cyclohexyl-1-oxidanylidene-1-[(2-oxidanylidene-4-phenoxy-azetidin-3-yl)amino]propan-2-yl]hexanamide Openeye Name: N-[1-(cyclohexylmethyl)-2-oxo-2-[(2-oxo-4-phenoxy-azetidin-3-yl)amino]ethyl]-6-guanidino-hexanamide CAS Name: N-[3-cyclohexyl-1-oxo-1-[(2-oxo-4-phenoxy-3-azetidinyl)amino]propan-2-yl]-6-(diaminomethylideneamino)hexanamide IUPAC Name: N-[3-cyclohexyl-1-oxo-1-[(2-oxo-4-phenoxyazetidin-3-yl)amino]propan-2-yl]-6-(diaminomethylideneamino)hexanamide Traditional Name: N-[1-(cyclohexylmethyl)-2-keto-2-[(2-keto-4-phenoxy-azetidin-3-yl)amino]ethyl]-6-guanidino-hexanamide Formula: C25H38N6O4 MolecularWeight: 486.60702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2C(NC2=O)OC3=CC=CC=C3)NC(=O)CCCCCN=C(N)N

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2C(NC2=O)OC3=CC=CC=C3)NC(=O)CCCCCN=C(N)N

InChI

InChI=1S/C25H38N6O4/c26-25(27)28-15-9-3-8-14-20(32)29-19(16-17-10-4-1-5-11-17)22(33)30-21-23(34)31-24(21)35-18-12-6-2-7-13-18/h2,6-7,12-13,17,19,21,24H,1,3-5,8-11,14-16H2,(H,29,32)(H,30,33)(H,31,34)(H4,26,27,28)