2-[[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenyl]-methyl-amino]propanoate

Systemtic Name: 2-[[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]phenyl]-methyl-amino]propanoate Openeye Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-N-methyl-anilino]propanoate CAS Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N-methylanilino]propanoate IUPAC Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)ethenyl]-N-methylanilino]propanoate Traditional Name: 2-[4-[(E)-2-(1,3-benzothiazol-2-yl)vinyl]-N-methyl-anilino]propionate Formula: C19H17N2O2S- MolecularWeight: 337.41548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])N(C)C1=CC=C(C=C1)C=CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)[O-])N(C)C1=CC=C(C=C1)/C=C/C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H18N2O2S/c1-13(19(22)23)21(2)15-10-7-14(8-11-15)9-12-18-20-16-5-3-4-6-17(16)24-18/h3-13H,1-2H3,(H,22,23)/p-1/b12-9+