(E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-N-methyl-prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)-N-methyl-prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)-N-methyl-prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-N-methyl-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-N-methylprop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)-N-methyl-acrylamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)N(C)CC2=NC3=CC=CC=C3S2)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)N(C)CC2=NC3=CC=CC=C3S2)Cl)OC

InChI

InChI=1S/C21H21ClN2O3S/c1-4-27-17-12-14(11-15(22)21(17)26-3)9-10-20(25)24(2)13-19-23-16-7-5-6-8-18(16)28-19/h5-12H,4,13H2,1-3H3/b10-9+