(2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-pyridin-4-ylethylideneamino]propanamide

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-pyridin-4-ylethylideneamino]propanamide Openeye Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-(4-pyridyl)ethylideneamino]propanamide CAS Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-[(Z)-1-pyridin-4-ylethylideneamino]propanamide IUPAC Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-pyridin-4-ylethylideneamino]propanamide Traditional Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-[(Z)-1-(4-pyridyl)ethylideneamino]propionamide Formula: C17H16N4OS2 MolecularWeight: 356.46514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4OS2/c1-11(13-7-9-18-10-8-13)20-21-16(22)12(2)23-17-19-14-5-3-4-6-15(14)24-17/h3-10,12H,1-2H3,(H,21,22)/b20-11-/t12-/m1/s1