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

Systemtic Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloranyl-5-ethoxy-4-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzothiazol-2-ylmethyl)-3-(3-chloro-5-ethoxy-4-methoxy-phenyl)acrylamide Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=CC(=O)NCC2=NC3=CC=CC=C3S2)Cl)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/C(=O)NCC2=NC3=CC=CC=C3S2)Cl)OC

InChI

InChI=1S/C20H19ClN2O3S/c1-3-26-16-11-13(10-14(21)20(16)25-2)8-9-18(24)22-12-19-23-15-6-4-5-7-17(15)27-19/h4-11H,3,12H2,1-2H3,(H,22,24)/b9-8+