2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2-propan-2-ylphenyl)butanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2-propan-2-ylphenyl)butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2-isopropylphenyl)butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-(2-propan-2-ylphenyl)butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-(2-propan-2-ylphenyl)butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-o-cumenyl-butyramide Formula: C17H25N5OS MolecularWeight: 347.4783

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(C)C)N2C(=NN=C2SCC)N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(C)C)N2C(=NN=C2SCC)N

InChI

InChI=1S/C17H25N5OS/c1-5-14(22-16(18)20-21-17(22)24-6-2)15(23)19-13-10-8-7-9-12(13)11(3)4/h7-11,14H,5-6H2,1-4H3,(H2,18,20)(H,19,23)