N-[(2S)-5-[bis(azanyl)methylideneamino]-1-(cyclododecylamino)-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[(2S)-5-[bis(azanyl)methylideneamino]-1-(cyclododecylamino)-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[(1S)-1-(cyclododecylcarbamoyl)-4-guanidino-butyl]benzamide CAS Name: N-[(2S)-1-(cyclododecylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(cyclododecylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S)-1-(cyclododecylcarbamoyl)-4-guanidino-butyl]benzamide Formula: C25H41N5O2 MolecularWeight: 443.62534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)NC(=O)C(CCCN=C(N)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCCCCC(CCCCC1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C25H41N5O2/c26-25(27)28-19-13-18-22(30-23(31)20-14-9-8-10-15-20)24(32)29-21-16-11-6-4-2-1-3-5-7-12-17-21/h8-10,14-15,21-22H,1-7,11-13,16-19H2,(H,29,32)(H,30,31)(H4,26,27,28)/t22-/m0/s1