2-azanyl-5-[bis(azanyl)methylideneamino]-N-[1-(4-phenoxyphenyl)ethyl]pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-[1-(4-phenoxyphenyl)ethyl]pentanamide Openeye Name: 2-amino-5-guanidino-N-[1-(4-phenoxyphenyl)ethyl]pentanamide CAS Name: 2-amino-5-(diaminomethylideneamino)-N-[1-(4-phenoxyphenyl)ethyl]pentanamide IUPAC Name: 2-amino-5-(diaminomethylideneamino)-N-[1-(4-phenoxyphenyl)ethyl]pentanamide Traditional Name: 2-amino-5-guanidino-N-[1-(4-phenoxyphenyl)ethyl]valeramide Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CC(C1=CC=C(C=C1)OC2=CC=CC=C2)NC(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C20H27N5O2/c1-14(25-19(26)18(21)8-5-13-24-20(22)23)15-9-11-17(12-10-15)27-16-6-3-2-4-7-16/h2-4,6-7,9-12,14,18H,5,8,13,21H2,1H3,(H,25,26)(H4,22,23,24)