(2S)-N-(4-azanyl-2-methoxy-phenyl)-2-[bis(cyanomethyl)amino]propanamide

Systemtic Name: (2S)-N-(4-azanyl-2-methoxy-phenyl)-2-[bis(cyanomethyl)amino]propanamide Openeye Name: (2S)-N-(4-amino-2-methoxy-phenyl)-2-[bis(cyanomethyl)amino]propanamide CAS Name: (2S)-N-(4-amino-2-methoxyphenyl)-2-[bis(cyanomethyl)amino]propanamide IUPAC Name: (2S)-N-(4-amino-2-methoxyphenyl)-2-[bis(cyanomethyl)amino]propanamide Traditional Name: (2S)-N-(4-amino-2-methoxy-phenyl)-2-[bis(cyanomethyl)amino]propionamide Formula: C14H17N5O2 MolecularWeight: 287.31708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)N)OC)N(CC#N)CC#N

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)N)OC)N(CC#N)CC#N

InChI

InChI=1S/C14H17N5O2/c1-10(19(7-5-15)8-6-16)14(20)18-12-4-3-11(17)9-13(12)21-2/h3-4,9-10H,7-8,17H2,1-2H3,(H,18,20)/t10-/m0/s1