propan-2-yl N-(1,3-benzothiazol-2-yl)-N'-ethyl-carbamimidate

Systemtic Name: propan-2-yl N-(1,3-benzothiazol-2-yl)-N'-ethyl-carbamimidate Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-ethyl-2-isopropyl-isourea CAS Name: N-(1,3-benzothiazol-2-yl)-N'-ethylcarbamimidic acid propan-2-yl ester IUPAC Name: propan-2-yl N-(1,3-benzothiazol-2-yl)-N'-ethylcarbamimidate Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-ethyl-2-isopropyl-isourea Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC1=NC2=CC=CC=C2S1)OC(C)C

Isomeric SMILES

CCN=C(NC1=NC2=CC=CC=C2S1)OC(C)C

InChI

InChI=1S/C13H17N3OS/c1-4-14-12(17-9(2)3)16-13-15-10-7-5-6-8-11(10)18-13/h5-9H,4H2,1-3H3,(H,14,15,16)