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

Systemtic Name: 7-chloranyl-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide Openeye Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]thiazol-2-yl]-1-benzoxepine-4-carboxamide CAS Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]-2-thiazolyl]-1-benzoxepin-4-carboxamide IUPAC Name: 7-chloro-N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-1-benzoxepine-4-carboxamide Traditional Name: 7-chloro-N-[5-(4-ethylbenzyl)thiazol-2-yl]-1-benzoxepin-4-carboxamide Formula: C23H19ClN2O2S MolecularWeight: 422.92716

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)Cl)OC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=CC(=C4)Cl)OC=C3

InChI

InChI=1S/C23H19ClN2O2S/c1-2-15-3-5-16(6-4-15)11-20-14-25-23(29-20)26-22(27)17-9-10-28-21-8-7-19(24)13-18(21)12-17/h3-10,12-14H,2,11H2,1H3,(H,25,26,27)