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

Systemtic Name: S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(6-methoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[(6-methoxy-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]ethyl] ester Formula: C17H20N2O4S2 MolecularWeight: 380.4817

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=C(S2)C=C(C=C3)OC

Isomeric SMILES

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=C(S2)C=C(C=C3)OC

InChI

InChI=1S/C17H20N2O4S2/c1-11(20)24-10-16(21)19(9-13-4-3-7-23-13)17-18-14-6-5-12(22-2)8-15(14)25-17/h5-6,8,13H,3-4,7,9-10H2,1-2H3