S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]-2-keto-ethyl] ester Formula: C18H22N2O4S2 MolecularWeight: 394.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C

InChI

InChI=1S/C18H22N2O4S2/c1-3-23-13-6-7-15-16(9-13)26-18(19-15)20(10-14-5-4-8-24-14)17(22)11-25-12(2)21/h6-7,9,14H,3-5,8,10-11H2,1-2H3