N-(5-azanyl-2-methyl-phenyl)-3-[bis(cyanomethyl)amino]propanamide

Systemtic Name: N-(5-azanyl-2-methyl-phenyl)-3-[bis(cyanomethyl)amino]propanamide Openeye Name: N-(5-amino-2-methyl-phenyl)-3-[bis(cyanomethyl)amino]propanamide CAS Name: N-(5-amino-2-methylphenyl)-3-[bis(cyanomethyl)amino]propanamide IUPAC Name: N-(5-amino-2-methylphenyl)-3-[bis(cyanomethyl)amino]propanamide Traditional Name: N-(5-amino-2-methyl-phenyl)-3-[bis(cyanomethyl)amino]propionamide Formula: C14H17N5O MolecularWeight: 271.31768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N5O/c1-11-2-3-12(17)10-13(11)18-14(20)4-7-19(8-5-15)9-6-16/h2-3,10H,4,7-9,17H2,1H3,(H,18,20)