(6S)-3-methylsulfanyl-6-thiophen-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Systemtic Name: (6S)-3-methylsulfanyl-6-thiophen-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: (6S)-3-methylsulfanyl-6-(2-thienyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: (6S)-3-(methylthio)-6-thiophen-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: (6S)-3-methylsulfanyl-6-thiophen-2-yl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: (6S)-3-(methylthio)-6-(2-thienyl)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C15H12N4OS2 MolecularWeight: 328.41198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(C3=CC=CC=C3NC(O2)C4=CC=CS4)N=N1

Isomeric SMILES

CSC1=NC2=C(C3=CC=CC=C3N[C@@H](O2)C4=CC=CS4)N=N1

InChI

InChI=1S/C15H12N4OS2/c1-21-15-17-14-12(18-19-15)9-5-2-3-6-10(9)16-13(20-14)11-7-4-8-22-11/h2-8,13,16H,1H3/t13-/m0/s1