1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone

Systemtic Name: 1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Openeye Name: 2-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone CAS Name: 1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]ethanone IUPAC Name: 1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]ethanone Traditional Name: 2-[(4-allyl-1,2,4-triazol-3-yl)thio]-1-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethanone Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SCC(=O)N2C(COC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C=CCN1C=NN=C1SCC(=O)N2C(COC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-2-12-24-15-22-23-21(24)28-14-20(26)25-17-10-6-7-11-19(17)27-13-18(25)16-8-4-3-5-9-16/h2-11,15,18H,1,12-14H2