N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromanyl-5-ethoxy-4-methoxy-benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromanyl-5-ethoxy-4-methoxy-benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-5-ethoxy-4-methoxy-benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-5-ethoxy-4-methoxybenzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-5-ethoxy-4-methoxybenzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-bromo-5-ethoxy-4-methoxy-benzamide Formula: C23H19BrN2O3S MolecularWeight: 483.37756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)Br)OC

InChI

InChI=1S/C23H19BrN2O3S/c1-3-29-19-13-14(12-16(24)21(19)28-2)22(27)25-17-9-5-4-8-15(17)23-26-18-10-6-7-11-20(18)30-23/h4-13H,3H2,1-2H3,(H,25,27)