3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl 2-thiophen-2-ylethanoate

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl 2-thiophen-2-ylethanoate Openeye Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl ester IUPAC Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propyl ester Formula: C16H16N2O4S2 MolecularWeight: 364.43924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC(=O)CC3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCCCOC(=O)CC3=CC=CS3

InChI

InChI=1S/C16H16N2O4S2/c19-15(11-12-5-3-10-23-12)22-9-4-8-17-16-13-6-1-2-7-14(13)24(20,21)18-16/h1-3,5-7,10H,4,8-9,11H2,(H,17,18)