N-[4-[2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[4-[2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-[2-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-2-oxo-ethyl]thiazol-2-yl]benzamide CAS Name: N-[4-[2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-thiazolyl]benzamide IUPAC Name: N-[4-[2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-2-oxoethyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[2-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-2-keto-ethyl]thiazol-2-yl]benzamide Formula: C21H20BrN3O3S MolecularWeight: 474.3708

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CC2=CSC(=N2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CC2=CSC(=N2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H20BrN3O3S/c1-25(12-15-10-16(22)8-9-18(15)28-2)19(26)11-17-13-29-21(23-17)24-20(27)14-6-4-3-5-7-14/h3-10,13H,11-12H2,1-2H3,(H,23,24,27)