(2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-phenylpropylideneamino]butanamide

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-phenylpropylideneamino]butanamide Openeye Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-phenylpropylideneamino]butanamide CAS Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-[(Z)-1-phenylpropylideneamino]butanamide IUPAC Name: (2R)-2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(Z)-1-phenylpropylideneamino]butanamide Traditional Name: (2R)-2-(1,3-benzothiazol-2-ylthio)-N-[(Z)-1-phenylpropylideneamino]butyramide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3OS2/c1-3-15(14-10-6-5-7-11-14)22-23-19(24)17(4-2)25-20-21-16-12-8-9-13-18(16)26-20/h5-13,17H,3-4H2,1-2H3,(H,23,24)/b22-15-/t17-/m1/s1