N-[2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide

Systemtic Name: N-[2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide Openeye Name: N-[2-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide CAS Name: N-[2-[[2-(tert-butylamino)-2-oxoethyl]thio]-1,3-benzothiazol-6-yl]propanamide IUPAC Name: N-[2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]propanamide Traditional Name: N-[2-[[2-(tert-butylamino)-2-keto-ethyl]thio]-1,3-benzothiazol-6-yl]propionamide Formula: C16H21N3O2S2 MolecularWeight: 351.48684

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC(C)(C)C

Isomeric SMILES

CCC(=O)NC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC(C)(C)C

InChI

InChI=1S/C16H21N3O2S2/c1-5-13(20)17-10-6-7-11-12(8-10)23-15(18-11)22-9-14(21)19-16(2,3)4/h6-8H,5,9H2,1-4H3,(H,17,20)(H,19,21)