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

Systemtic Name: S-[2-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[1,3-benzothiazol-2-yl(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[1,3-benzothiazol-2-yl(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[1,3-benzothiazol-2-yl(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[1,3-benzothiazol-2-yl(tetrahydrofurfuryl)amino]-2-keto-ethyl] ester Formula: C16H18N2O3S2 MolecularWeight: 350.45572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H18N2O3S2/c1-11(19)22-10-15(20)18(9-12-5-4-8-21-12)16-17-13-6-2-3-7-14(13)23-16/h2-3,6-7,12H,4-5,8-10H2,1H3