(2R)-N-tert-butyl-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide

Systemtic Name: (2R)-N-tert-butyl-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-N-tert-butyl-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2R)-N-tert-butyl-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-N-tert-butyl-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-benzyl-N-tert-butyl-2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)C(C)(C)C)SC2=NNC(=O)N2C3CC3

Isomeric SMILES

C[C@H](C(=O)N(CC1=CC=CC=C1)C(C)(C)C)SC2=NNC(=O)N2C3CC3

InChI

InChI=1S/C19H26N4O2S/c1-13(26-18-21-20-17(25)23(18)15-10-11-15)16(24)22(19(2,3)4)12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,20,25)/t13-/m1/s1