3,5-dimethyl-N-[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]-1,2-oxazole-4-carboxamide

Systemtic Name: 3,5-dimethyl-N-[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]-1,2-oxazole-4-carboxamide Openeye Name: N-[2-(2-isopropylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: 3,5-dimethyl-N-[2-[2-(propan-2-ylthio)ethylthio]-1,3-benzothiazol-6-yl]-4-isoxazolecarboxamide IUPAC Name: 3,5-dimethyl-N-[2-(2-propan-2-ylsulfanylethylsulfanyl)-1,3-benzothiazol-6-yl]-1,2-oxazole-4-carboxamide Traditional Name: N-[2-[2-(isopropylthio)ethylthio]-1,3-benzothiazol-6-yl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C18H21N3O2S3 MolecularWeight: 407.57324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCSC(C)C

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCCSC(C)C

InChI

InChI=1S/C18H21N3O2S3/c1-10(2)24-7-8-25-18-20-14-6-5-13(9-15(14)26-18)19-17(22)16-11(3)21-23-12(16)4/h5-6,9-10H,7-8H2,1-4H3,(H,19,22)