3-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 3-[[(E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoyl]amino]-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 3-[[(E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoyl]amino]-N-thiazol-2-yl-benzamide CAS Name: 3-[[(E)-3-(5-bromo-2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-N-(2-thiazolyl)benzamide IUPAC Name: 3-[[(E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoyl]amino]-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 3-[[(E)-3-(5-bromo-2-methoxy-phenyl)acryloyl]amino]-N-thiazol-2-yl-benzamide Formula: C20H16BrN3O3S MolecularWeight: 458.32834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=CC(=C2)C(=O)NC3=NC=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC=CC(=C2)C(=O)NC3=NC=CS3

InChI

InChI=1S/C20H16BrN3O3S/c1-27-17-7-6-15(21)11-13(17)5-8-18(25)23-16-4-2-3-14(12-16)19(26)24-20-22-9-10-28-20/h2-12H,1H3,(H,23,25)(H,22,24,26)/b8-5+