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

Systemtic Name: S-[2-[(6-methyl-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(6-methyl-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(6-methyl-1,3-benzothiazol-2-yl)-(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(6-methyl-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]ethyl] ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C

InChI

InChI=1S/C17H20N2O3S2/c1-11-5-6-14-15(8-11)24-17(18-14)19(9-13-4-3-7-22-13)16(21)10-23-12(2)20/h5-6,8,13H,3-4,7,9-10H2,1-2H3