3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(morpholinomethyl)thiazol-2-yl]propanamide CAS Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(4-morpholinylmethyl)-2-thiazolyl]propanamide IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-N-[4-(morpholinomethyl)thiazol-2-yl]propionamide Formula: C18H22BrN3O3S MolecularWeight: 440.35458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)CN3CCOCC3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2=NC(=CS2)CN3CCOCC3)Br

InChI

InChI=1S/C18H22BrN3O3S/c1-24-16-4-2-13(10-15(16)19)3-5-17(23)21-18-20-14(12-26-18)11-22-6-8-25-9-7-22/h2,4,10,12H,3,5-9,11H2,1H3,(H,20,21,23)