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

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[[4-azanyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[[4-amino-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[[4-amino-5-(2-furyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H26N6O3S MolecularWeight: 430.52384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NN=C(N4N)C5=CC=CO5

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)SC4=NN=C(N4N)C5=CC=CO5

InChI

InChI=1S/C20H26N6O3S/c1-11(30-19-25-24-16(26(19)21)15-3-2-4-29-15)17(27)22-18(28)23-20-8-12-5-13(9-20)7-14(6-12)10-20/h2-4,11-14H,5-10,21H2,1H3,(H2,22,23,27,28)