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

Systemtic Name: S-[2-oxidanylidene-2-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl] ethanethioate Openeye Name: S-[2-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-oxo-2-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]ethyl] ester IUPAC Name: S-[2-oxo-2-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]-2-keto-ethyl] ester Formula: C18H23N3O2S2 MolecularWeight: 377.52412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC(=O)C

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC(=O)C

InChI

InChI=1S/C18H23N3O2S2/c1-12(2)14-5-4-6-15-17(14)19-18(25-15)21-9-7-20(8-10-21)16(23)11-24-13(3)22/h4-6,12H,7-11H2,1-3H3