2-[(4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[(4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[(5-allylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[[4-phenyl-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[(4-phenyl-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[[5-(allylthio)-4-phenyl-1,2,4-triazol-3-yl]methylthio]quinazolin-4-one Formula: C23H21N5OS2 MolecularWeight: 447.57574

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(N3C4=CC=CC=C4)SCC=C

Isomeric SMILES

C=CCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(N3C4=CC=CC=C4)SCC=C

InChI

InChI=1S/C23H21N5OS2/c1-3-14-27-21(29)18-12-8-9-13-19(18)24-22(27)31-16-20-25-26-23(30-15-4-2)28(20)17-10-6-5-7-11-17/h3-13H,1-2,14-16H2