3-[3-(furan-2-yl)-5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-(furan-2-yl)-5-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(2-furyl)-5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-(2-furanyl)-5-[(4-oxo-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-(furan-2-yl)-5-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-(2-furyl)-5-[(4-keto-1H-quinazolin-2-yl)methylthio]-1,2,4-triazol-4-yl]propionamide Formula: C18H16N6O3S MolecularWeight: 396.42304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NN=C(N3CCC(=O)N)C4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSC3=NN=C(N3CCC(=O)N)C4=CC=CO4

InChI

InChI=1S/C18H16N6O3S/c19-14(25)7-8-24-16(13-6-3-9-27-13)22-23-18(24)28-10-15-20-12-5-2-1-4-11(12)17(26)21-15/h1-6,9H,7-8,10H2,(H2,19,25)(H,20,21,26)