(2S)-2-[[5-(furan-2-yl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Systemtic Name: (2S)-2-[[5-(furan-2-yl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Openeye Name: (2S)-2-[[4-benzyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methylisoxazol-3-yl)propanamide CAS Name: (2S)-2-[[5-(2-furanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-3-isoxazolyl)propanamide IUPAC Name: (2S)-2-[[4-benzyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)propanamide Traditional Name: (2S)-2-[[4-benzyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C20H19N5O3S/c1-13-11-17(24-28-13)21-19(26)14(2)29-20-23-22-18(16-9-6-10-27-16)25(20)12-15-7-4-3-5-8-15/h3-11,14H,12H2,1-2H3,(H,21,24,26)/t14-/m0/s1