N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-phenylsulfanyl-propanamide Openeye Name: N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-phenylsulfanyl-propanamide CAS Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(phenylthio)propanamide IUPAC Name: N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-phenylsulfanylpropanamide Traditional Name: 2-(phenylthio)-N-[(E)-piperonylideneamino]propionamide Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC2=C(C=C1)OCO2)SC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC2=C(C=C1)OCO2)SC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O3S/c1-12(23-14-5-3-2-4-6-14)17(20)19-18-10-13-7-8-15-16(9-13)22-11-21-15/h2-10,12H,11H2,1H3,(H,19,20)/b18-10+