7-bromanyl-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide

Systemtic Name: 7-bromanyl-N-[5-(phenylmethyl)-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide Openeye Name: N-(5-benzylthiazol-2-yl)-7-bromo-1-benzoxepine-4-carboxamide CAS Name: 7-bromo-N-[5-(phenylmethyl)-2-thiazolyl]-1-benzoxepin-4-carboxamide IUPAC Name: N-(5-benzyl-1,3-thiazol-2-yl)-7-bromo-1-benzoxepine-4-carboxamide Traditional Name: N-(5-benzylthiazol-2-yl)-7-bromo-1-benzoxepin-4-carboxamide Formula: C21H15BrN2O2S MolecularWeight: 439.325

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)Br)OC=C3

InChI

InChI=1S/C21H15BrN2O2S/c22-17-6-7-19-16(12-17)11-15(8-9-26-19)20(25)24-21-23-13-18(27-21)10-14-4-2-1-3-5-14/h1-9,11-13H,10H2,(H,23,24,25)