S-[2-oxidanylidene-2-[oxolan-2-ylmethyl-(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate

Systemtic Name: S-[2-oxidanylidene-2-[oxolan-2-ylmethyl-(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate Openeye Name: S-[2-[(4-isopropyl-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[2-oxolanylmethyl-(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ester IUPAC Name: S-[2-oxo-2-[oxolan-2-ylmethyl-(4-propan-2-yl-1,3-benzothiazol-2-yl)amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(4-isopropyl-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]-2-keto-ethyl] ester Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3CCCO3)C(=O)CSC(=O)C

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N(CC3CCCO3)C(=O)CSC(=O)C

InChI

InChI=1S/C19H24N2O3S2/c1-12(2)15-7-4-8-16-18(15)20-19(26-16)21(10-14-6-5-9-24-14)17(23)11-25-13(3)22/h4,7-8,12,14H,5-6,9-11H2,1-3H3