N-(1-adamantylmethyl)-2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)CSC4=NN=C(N4N)C5=CC=CO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)CSC4=NN=C(N4N)C5=CC=CO5

InChI

InChI=1S/C19H25N5O2S/c20-24-17(15-2-1-3-26-15)22-23-18(24)27-10-16(25)21-11-19-7-12-4-13(8-19)6-14(5-12)9-19/h1-3,12-14H,4-11,20H2,(H,21,25)