2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-furan-2-yl)butanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-furan-2-yl)butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenyl-2-furyl)butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-diphenyl-2-furanyl)butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(3-cyano-4,5-diphenylfuran-2-yl)butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(3-cyano-4,5-diphenyl-2-furyl)butyramide Formula: C25H24N6O2S MolecularWeight: 472.56206

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)N4C(=NN=C4SCC)N

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3)C#N)N4C(=NN=C4SCC)N

InChI

InChI=1S/C25H24N6O2S/c1-3-19(31-24(27)29-30-25(31)34-4-2)22(32)28-23-18(15-26)20(16-11-7-5-8-12-16)21(33-23)17-13-9-6-10-14-17/h5-14,19H,3-4H2,1-2H3,(H2,27,29)(H,28,32)