N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-bromanyl-4-ethoxy-benzamide

Systemtic Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-bromanyl-4-ethoxy-benzamide Openeye Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-bromo-4-ethoxy-benzamide CAS Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-bromo-4-ethoxybenzamide IUPAC Name: N-[[4-(1,3-benzothiazol-2-yl)phenyl]methyl]-3-bromo-4-ethoxybenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)benzyl]-3-bromo-4-ethoxy-benzamide Formula: C23H19BrN2O2S MolecularWeight: 467.37816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3)Br

InChI

InChI=1S/C23H19BrN2O2S/c1-2-28-20-12-11-17(13-18(20)24)22(27)25-14-15-7-9-16(10-8-15)23-26-19-5-3-4-6-21(19)29-23/h3-13H,2,14H2,1H3,(H,25,27)