N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-piperonylamide Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=CC=C3SCC(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=CC=CC=C3SCC(=O)N

InChI

InChI=1S/C16H14N2O4S/c17-15(19)8-23-14-4-2-1-3-11(14)18-16(20)10-5-6-12-13(7-10)22-9-21-12/h1-7H,8-9H2,(H2,17,19)(H,18,20)