S-[2-[(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]-2-keto-ethyl] ester Formula: C17H19ClN2O3S2 MolecularWeight: 398.92736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)N(CC3CCCO3)C(=O)CSC(=O)C)Cl

InChI

InChI=1S/C17H19ClN2O3S2/c1-10-13(18)5-6-14-16(10)19-17(25-14)20(8-12-4-3-7-23-12)15(22)9-24-11(2)21/h5-6,12H,3-4,7-9H2,1-2H3