N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-piperonylamide Formula: C14H13N3O4S2 MolecularWeight: 351.40072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)OCO3)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC3=C(C=C2)OCO3)SCC(=O)N

InChI

InChI=1S/C14H13N3O4S2/c1-7-13(22-5-11(15)18)23-14(16-7)17-12(19)8-2-3-9-10(4-8)21-6-20-9/h2-4H,5-6H2,1H3,(H2,15,18)(H,16,17,19)