N-[(2S)-1-(3-azanylpentylamino)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]benzamide

Systemtic Name: N-[(2S)-1-(3-azanylpentylamino)-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[(1S)-1-(3-aminopentylcarbamoyl)-4-guanidino-butyl]benzamide CAS Name: N-[(2S)-1-(3-aminopentylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(3-aminopentylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S)-1-(3-aminopentylcarbamoyl)-4-guanidino-butyl]benzamide Formula: C18H30N6O2 MolecularWeight: 362.4698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCNC(=O)C(CCCN=C(N)N)NC(=O)C1=CC=CC=C1)N

Isomeric SMILES

CCC(CCNC(=O)[C@H](CCCN=C(N)N)NC(=O)C1=CC=CC=C1)N

InChI

InChI=1S/C18H30N6O2/c1-2-14(19)10-12-22-17(26)15(9-6-11-23-18(20)21)24-16(25)13-7-4-3-5-8-13/h3-5,7-8,14-15H,2,6,9-12,19H2,1H3,(H,22,26)(H,24,25)(H4,20,21,23)/t14?,15-/m0/s1