(2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-phenoxypropan-2-ylideneamino]propanamide

Systemtic Name: (2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-phenoxypropan-2-ylideneamino]propanamide Openeye Name: (2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-(1-methyl-2-phenoxy-ethylidene)amino]propanamide CAS Name: (2S)-2-(1,3-benzothiazol-2-ylthio)-N-[(E)-1-phenoxypropan-2-ylideneamino]propanamide IUPAC Name: (2S)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(E)-1-phenoxypropan-2-ylideneamino]propanamide Traditional Name: (2S)-2-(1,3-benzothiazol-2-ylthio)-N-[(E)-(1-methyl-2-phenoxy-ethylidene)amino]propionamide Formula: C19H19N3O2S2 MolecularWeight: 385.50306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=C(C)COC1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

C[C@@H](C(=O)N/N=C(\C)/COC1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O2S2/c1-13(12-24-15-8-4-3-5-9-15)21-22-18(23)14(2)25-19-20-16-10-6-7-11-17(16)26-19/h3-11,14H,12H2,1-2H3,(H,22,23)/b21-13+/t14-/m0/s1