(6S)-6-[2-(furan-2-yl)ethenyl]-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Systemtic Name: (6S)-6-[2-(furan-2-yl)ethenyl]-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Openeye Name: (6S)-3-allylsulfanyl-6-[2-(2-furyl)vinyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine CAS Name: (6S)-6-[2-(2-furanyl)ethenyl]-3-(prop-2-enylthio)-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine IUPAC Name: (6S)-6-[2-(furan-2-yl)ethenyl]-3-prop-2-enylsulfanyl-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Traditional Name: (6S)-3-(allylthio)-6-[2-(2-furyl)vinyl]-6,7-dihydro-[1,2,4]triazino[5,6-d][3,1]benzoxazepine Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(C3=CC=CC=C3NC(O2)C=CC4=CC=CO4)N=N1

Isomeric SMILES

C=CCSC1=NC2=C(C3=CC=CC=C3N[C@@H](O2)C=CC4=CC=CO4)N=N1

InChI

InChI=1S/C19H16N4O2S/c1-2-12-26-19-21-18-17(22-23-19)14-7-3-4-8-15(14)20-16(25-18)10-9-13-6-5-11-24-13/h2-11,16,20H,1,12H2/t16-/m0/s1