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

Systemtic Name: N-(4-azanyl-2-chloranyl-phenyl)-4-[bis(cyanomethyl)amino]butanamide Openeye Name: N-(4-amino-2-chloro-phenyl)-4-[bis(cyanomethyl)amino]butanamide CAS Name: N-(4-amino-2-chlorophenyl)-4-[bis(cyanomethyl)amino]butanamide IUPAC Name: N-(4-amino-2-chlorophenyl)-4-[bis(cyanomethyl)amino]butanamide Traditional Name: N-(4-amino-2-chloro-phenyl)-4-[bis(cyanomethyl)amino]butyramide Formula: C14H16ClN5O MolecularWeight: 305.76274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)Cl)NC(=O)CCCN(CC#N)CC#N

Isomeric SMILES

C1=CC(=C(C=C1N)Cl)NC(=O)CCCN(CC#N)CC#N

InChI

InChI=1S/C14H16ClN5O/c15-12-10-11(18)3-4-13(12)19-14(21)2-1-7-20(8-5-16)9-6-17/h3-4,10H,1-2,7-9,18H2,(H,19,21)