N-[1-[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: N-[1-[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: N-[1-[4-allyl-5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: N-[1-[5-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: N-[1-[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: N-[1-[4-allyl-5-[(4-keto-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C23H22N6O2S MolecularWeight: 446.52478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1CC=C)SCC2=NC(=O)C3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C1=NN=C(N1CC=C)SCC2=NC(=O)C3=CC=CC=C3N2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N6O2S/c1-3-13-29-20(15(2)24-21(30)16-9-5-4-6-10-16)27-28-23(29)32-14-19-25-18-12-8-7-11-17(18)22(31)26-19/h3-12,15H,1,13-14H2,2H3,(H,24,30)(H,25,26,31)