2-azanyl-N-(cyanomethyl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: 2-azanyl-N-(cyanomethyl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 2-amino-3-benzylsulfonyl-N-(cyanomethyl)propanamide CAS Name: 2-amino-N-(cyanomethyl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 2-amino-3-benzylsulfonyl-N-(cyanomethyl)propanamide Traditional Name: 2-amino-3-benzylsulfonyl-N-(cyanomethyl)propionamide Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC(C(=O)NCC#N)N

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC(C(=O)NCC#N)N

InChI

InChI=1S/C12H15N3O3S/c13-6-7-15-12(16)11(14)9-19(17,18)8-10-4-2-1-3-5-10/h1-5,11H,7-9,14H2,(H,15,16)