4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]-3,5-dihydro-2H-1,4-benzoxazepine Formula: C16H15N3O2S MolecularWeight: 313.3742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2CN1CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1COC2=CC=CC=C2CN1CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C16H15N3O2S/c1-2-5-13-12(4-1)10-19(7-8-20-13)11-15-17-16(18-21-15)14-6-3-9-22-14/h1-6,9H,7-8,10-11H2