N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-6-bromanyl-2H-chromene-3-carboxamide

Systemtic Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-6-bromanyl-2H-chromene-3-carboxamide Openeye Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-6-bromo-2H-chromene-3-carboxamide CAS Name: N-[4-[4-(acetamidomethyl)phenyl]-2-thiazolyl]-6-bromo-2H-1-benzopyran-3-carboxamide IUPAC Name: N-[4-[4-(acetamidomethyl)phenyl]-1,3-thiazol-2-yl]-6-bromo-2H-chromene-3-carboxamide Traditional Name: N-[4-[4-(acetamidomethyl)phenyl]thiazol-2-yl]-6-bromo-2H-chromene-3-carboxamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC3

InChI

InChI=1S/C22H18BrN3O3S/c1-13(27)24-10-14-2-4-15(5-3-14)19-12-30-22(25-19)26-21(28)17-8-16-9-18(23)6-7-20(16)29-11-17/h2-9,12H,10-11H2,1H3,(H,24,27)(H,25,26,28)