(2R)-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)propanamide Openeye Name: (2R)-2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)propanamide CAS Name: (2R)-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2R)-2-[(5-cyclohexyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(methylcarbamoyl)propanamide Traditional Name: (2R)-2-[(4-allyl-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-(methylcarbamoyl)propionamide Formula: C16H25N5O2S MolecularWeight: 351.467

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NN=C(N1CC=C)C2CCCCC2

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)SC1=NN=C(N1CC=C)C2CCCCC2

InChI

InChI=1S/C16H25N5O2S/c1-4-10-21-13(12-8-6-5-7-9-12)19-20-16(21)24-11(2)14(22)18-15(23)17-3/h4,11-12H,1,5-10H2,2-3H3,(H2,17,18,22,23)/t11-/m1/s1