2-(phenylmethylsulfanyl)-N-[(E)-[4-(thietan-3-yloxy)phenyl]methylideneamino]propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[(E)-[4-(thietan-3-yloxy)phenyl]methylideneamino]propanamide Openeye Name: 2-benzylsulfanyl-N-[(E)-[4-(thietan-3-yloxy)phenyl]methyleneamino]propanamide CAS Name: 2-(phenylmethylthio)-N-[(E)-[4-(3-thietanyloxy)phenyl]methylideneamino]propanamide IUPAC Name: 2-benzylsulfanyl-N-[(E)-[4-(thietan-3-yloxy)phenyl]methylideneamino]propanamide Traditional Name: 2-(benzylthio)-N-[(E)-[4-(thietan-3-yloxy)benzylidene]amino]propionamide Formula: C20H22N2O2S2 MolecularWeight: 386.53088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC=C(C=C1)OC2CSC2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC=C(C=C1)OC2CSC2)SCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S2/c1-15(26-12-17-5-3-2-4-6-17)20(23)22-21-11-16-7-9-18(10-8-16)24-19-13-25-14-19/h2-11,15,19H,12-14H2,1H3,(H,22,23)/b21-11+