1,1-bis(oxidanylidene)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine Openeye Name: 1,1-dioxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine CAS Name: 1,1-dioxo-N-[3-(1-pyrrolidinylmethyl)phenyl]-4-thianamine IUPAC Name: 1,1-dioxo-N-[3-(pyrrolidin-1-ylmethyl)phenyl]thian-4-amine Traditional Name: (1,1-diketothian-4-yl)-[3-(pyrrolidinomethyl)phenyl]amine Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)NC3CCS(=O)(=O)CC3

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)NC3CCS(=O)(=O)CC3

InChI

InChI=1S/C16H24N2O2S/c19-21(20)10-6-15(7-11-21)17-16-5-3-4-14(12-16)13-18-8-1-2-9-18/h3-5,12,15,17H,1-2,6-11,13H2