N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide

Systemtic Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide Openeye Name: N-[5-[(3-chlorophenyl)methyl]thiazol-2-yl]-1-benzoxepine-4-carboxamide CAS Name: N-[5-[(3-chlorophenyl)methyl]-2-thiazolyl]-1-benzoxepin-4-carboxamide IUPAC Name: N-[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide Traditional Name: N-[5-(3-chlorobenzyl)thiazol-2-yl]-1-benzoxepin-4-carboxamide Formula: C21H15ClN2O2S MolecularWeight: 394.874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=CO2)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=CO2)C(=O)NC3=NC=C(S3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H15ClN2O2S/c22-17-6-3-4-14(10-17)11-18-13-23-21(27-18)24-20(25)16-8-9-26-19-7-2-1-5-15(19)12-16/h1-10,12-13H,11H2,(H,23,24,25)