N-(2-azanylethyl)-3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonyl-propanamide

Systemtic Name: N-(2-azanylethyl)-3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfonyl-propanamide Openeye Name: N-(2-aminoethyl)-3-(2-anilino-2-oxo-ethyl)sulfonyl-propanamide CAS Name: N-(2-aminoethyl)-3-(2-anilino-2-oxoethyl)sulfonylpropanamide IUPAC Name: N-(2-aminoethyl)-3-(2-anilino-2-oxoethyl)sulfonylpropanamide Traditional Name: N-(2-aminoethyl)-3-(2-anilino-2-keto-ethyl)sulfonyl-propionamide Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CCC(=O)NCCN

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CS(=O)(=O)CCC(=O)NCCN

InChI

InChI=1S/C13H19N3O4S/c14-7-8-15-12(17)6-9-21(19,20)10-13(18)16-11-4-2-1-3-5-11/h1-5H,6-10,14H2,(H,15,17)(H,16,18)