N-(3-azanyl-2-methyl-phenyl)-4-[bis(cyanomethyl)amino]butanamide

Systemtic Name: N-(3-azanyl-2-methyl-phenyl)-4-[bis(cyanomethyl)amino]butanamide Openeye Name: N-(3-amino-2-methyl-phenyl)-4-[bis(cyanomethyl)amino]butanamide CAS Name: N-(3-amino-2-methylphenyl)-4-[bis(cyanomethyl)amino]butanamide IUPAC Name: N-(3-amino-2-methylphenyl)-4-[bis(cyanomethyl)amino]butanamide Traditional Name: N-(3-amino-2-methyl-phenyl)-4-[bis(cyanomethyl)amino]butyramide Formula: C15H19N5O MolecularWeight: 285.34426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCCN(CC#N)CC#N)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCCN(CC#N)CC#N)N

InChI

InChI=1S/C15H19N5O/c1-12-13(18)4-2-5-14(12)19-15(21)6-3-9-20(10-7-16)11-8-17/h2,4-5H,3,6,9-11,18H2,1H3,(H,19,21)