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

Systemtic Name: N-[(2S)-5-[bis(azanyl)methylideneamino]-1-(cycloheptylamino)-1-oxidanylidene-pentan-2-yl]benzamide Openeye Name: N-[(1S)-1-(cycloheptylcarbamoyl)-4-guanidino-butyl]benzamide CAS Name: N-[(2S)-1-(cycloheptylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide IUPAC Name: N-[(2S)-1-(cycloheptylamino)-5-(diaminomethylideneamino)-1-oxopentan-2-yl]benzamide Traditional Name: N-[(1S)-1-(cycloheptylcarbamoyl)-4-guanidino-butyl]benzamide Formula: C20H31N5O2 MolecularWeight: 373.49244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C(CCCN=C(N)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCCC(CC1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H31N5O2/c21-20(22)23-14-8-13-17(25-18(26)15-9-4-3-5-10-15)19(27)24-16-11-6-1-2-7-12-16/h3-5,9-10,16-17H,1-2,6-8,11-14H2,(H,24,27)(H,25,26)(H4,21,22,23)/t17-/m0/s1