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

Systemtic Name: N-[2-methyl-1-[5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]propyl]benzamide Openeye Name: N-[1-[4-allyl-5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide CAS Name: N-[2-methyl-1-[5-[(4-oxo-1H-quinazolin-2-yl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]propyl]benzamide IUPAC Name: N-[2-methyl-1-[5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]propyl]benzamide Traditional Name: N-[1-[4-allyl-5-[(4-keto-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Formula: C25H26N6O2S MolecularWeight: 474.57794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N6O2S/c1-4-14-31-22(21(16(2)3)28-23(32)17-10-6-5-7-11-17)29-30-25(31)34-15-20-26-19-13-9-8-12-18(19)24(33)27-20/h4-13,16,21H,1,14-15H2,2-3H3,(H,28,32)(H,26,27,33)