S-[2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(tetrahydrofuran-2-ylmethyl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(2-oxolanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(oxolan-2-ylmethyl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(tetrahydrofurfuryl)amino]-2-keto-ethyl] ester Formula: C17H19ClN2O4S2 MolecularWeight: 414.92676

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=C(C=CC(=C3S2)Cl)OC

Isomeric SMILES

CC(=O)SCC(=O)N(CC1CCCO1)C2=NC3=C(C=CC(=C3S2)Cl)OC

InChI

InChI=1S/C17H19ClN2O4S2/c1-10(21)25-9-14(22)20(8-11-4-3-7-24-11)17-19-15-13(23-2)6-5-12(18)16(15)26-17/h5-6,11H,3-4,7-9H2,1-2H3