N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxy-propanamide

Systemtic Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxy-propanamide Openeye Name: 2-(isopropylideneamino)oxy-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]propanamide CAS Name: N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxypropanamide IUPAC Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-(propan-2-ylideneamino)oxypropanamide Traditional Name: 2-(isopropylideneamino)oxy-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]propionamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3OC)ON=C(C)C

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)SCC3=CC=CC=C3OC)ON=C(C)C

InChI

InChI=1S/C21H23N3O3S2/c1-13(2)24-27-14(3)20(25)22-16-9-10-17-19(11-16)29-21(23-17)28-12-15-7-5-6-8-18(15)26-4/h5-11,14H,12H2,1-4H3,(H,22,25)