N-[(2S)-1-(4-azanylbutylamino)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-(4-azanylbutylamino)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[(1S)-1-(4-aminobutylcarbamoyl)-4-guanidino-butyl]benzamide CAS Name: N-[(2S)-1-(4-aminobutylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(4-aminobutylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S)-1-(4-aminobutylcarbamoyl)-4-guanidino-butyl]benzamide Formula: C17H28N6O2 MolecularWeight: 348.44322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NCCCCN

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCCCCN

InChI

InChI=1S/C17H28N6O2/c18-10-4-5-11-21-16(25)14(9-6-12-22-17(19)20)23-15(24)13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12,18H2,(H,21,25)(H,23,24)(H4,19,20,22)/t14-/m0/s1