N-(4-aminophenyl)-3-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]propanamide

Systemtic Name: N-(4-aminophenyl)-3-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]propanamide Openeye Name: N-(4-aminophenyl)-3-[(1,1-dioxothiolan-3-yl)-methyl-amino]propanamide CAS Name: N-(4-aminophenyl)-3-[(1,1-dioxo-3-thiolanyl)-methylamino]propanamide IUPAC Name: N-(4-aminophenyl)-3-[(1,1-dioxothiolan-3-yl)-methylamino]propanamide Traditional Name: N-(4-aminophenyl)-3-[(1,1-diketothiolan-3-yl)-methyl-amino]propionamide Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=CC=C(C=C1)N)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CCC(=O)NC1=CC=C(C=C1)N)C2CCS(=O)(=O)C2

InChI

InChI=1S/C14H21N3O3S/c1-17(13-7-9-21(19,20)10-13)8-6-14(18)16-12-4-2-11(15)3-5-12/h2-5,13H,6-10,15H2,1H3,(H,16,18)