3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(1-naphthylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(1-naphthalenylmethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(naphthalen-1-ylmethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]-5-(1-naphthylmethylthio)-1,2,4-triazole Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)C4COC5=CC=CC=C5O4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC=CC3=CC=CC=C32)[C@H]4COC5=CC=CC=C5O4

InChI

InChI=1S/C24H21N3O2S/c1-2-14-27-23(22-15-28-20-12-5-6-13-21(20)29-22)25-26-24(27)30-16-18-10-7-9-17-8-3-4-11-19(17)18/h2-13,22H,1,14-16H2/t22-/m1/s1