6-chloranyl-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide

Systemtic Name: 6-chloranyl-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Openeye Name: 6-chloro-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide CAS Name: 6-chloro-N-[4-(4-methoxyphenyl)-2-thiazolyl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide IUPAC Name: 6-chloro-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide Traditional Name: 6-chloro-N-[4-(4-methoxyphenyl)thiazol-2-yl]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxamide Formula: C20H17ClN2O4S MolecularWeight: 416.87798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C20H17ClN2O4S/c1-25-14-5-3-12(4-6-14)16-11-28-20(22-16)23-19(24)13-9-15(21)18-17(10-13)26-7-2-8-27-18/h3-6,9-11H,2,7-8H2,1H3,(H,22,23,24)