S-[1-[4-(2-methylpentan-3-ylcarbamoyl)-1,3-thiazol-2-yl]azetidin-3-yl] ethanethioate

Systemtic Name: S-[1-[4-(2-methylpentan-3-ylcarbamoyl)-1,3-thiazol-2-yl]azetidin-3-yl] ethanethioate Openeye Name: S-[1-[4-[(1-ethyl-2-methyl-propyl)carbamoyl]thiazol-2-yl]azetidin-3-yl] ethanethioate CAS Name: ethanethioic acid S-[1-[4-[(2-methylpentan-3-ylamino)-oxomethyl]-2-thiazolyl]-3-azetidinyl] ester IUPAC Name: S-[1-[4-(2-methylpentan-3-ylcarbamoyl)-1,3-thiazol-2-yl]azetidin-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[1-[4-[(1-ethyl-2-methyl-propyl)carbamoyl]thiazol-2-yl]azetidin-3-yl] ester Formula: C15H23N3O2S2 MolecularWeight: 341.49202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)C)NC(=O)C1=CSC(=N1)N2CC(C2)SC(=O)C

Isomeric SMILES

CCC(C(C)C)NC(=O)C1=CSC(=N1)N2CC(C2)SC(=O)C

InChI

InChI=1S/C15H23N3O2S2/c1-5-12(9(2)3)16-14(20)13-8-21-15(17-13)18-6-11(7-18)22-10(4)19/h8-9,11-12H,5-7H2,1-4H3,(H,16,20)