3-[bis(azanyl)methylideneamino]-N-(2,6-dimethylphenyl)propanamide

Systemtic Name: 3-[bis(azanyl)methylideneamino]-N-(2,6-dimethylphenyl)propanamide Openeye Name: N-(2,6-dimethylphenyl)-3-guanidino-propanamide CAS Name: 3-(diaminomethylideneamino)-N-(2,6-dimethylphenyl)propanamide IUPAC Name: 3-(diaminomethylideneamino)-N-(2,6-dimethylphenyl)propanamide Traditional Name: N-(2,6-dimethylphenyl)-3-guanidino-propionamide Formula: C12H18N4O MolecularWeight: 234.29752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCN=C(N)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCN=C(N)N

InChI

InChI=1S/C12H18N4O/c1-8-4-3-5-9(2)11(8)16-10(17)6-7-15-12(13)14/h3-5H,6-7H2,1-2H3,(H,16,17)(H4,13,14,15)