(2R)-N-(1-adamantylcarbamoyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(1-adamantylcarbamoyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(1-adamantylcarbamoyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-[(1-adamantylamino)-oxomethyl]-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(1-adamantylcarbamoyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(1-adamantylcarbamoyl)-2-[(4-ethyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C18H27N5O2S MolecularWeight: 377.50428

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SC(C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN1C=NN=C1S[C@H](C)C(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C18H27N5O2S/c1-3-23-10-19-22-17(23)26-11(2)15(24)20-16(25)21-18-7-12-4-13(8-18)6-14(5-12)9-18/h10-14H,3-9H2,1-2H3,(H2,20,21,24,25)/t11-,12?,13?,14?,18?/m1/s1