2-azanyl-4-chloranyl-N-[(2S,3R)-3-oxidanyl-3-phenyl-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide

Systemtic Name: 2-azanyl-4-chloranyl-N-[(2S,3R)-3-oxidanyl-3-phenyl-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide Openeye Name: 2-amino-4-chloro-N-[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-3-(1,2,4-triazol-1-yl)propyl]benzamide CAS Name: 2-amino-4-chloro-N-[(2S,3R)-3-hydroxy-3-phenyl-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide IUPAC Name: 2-amino-4-chloro-N-[(2S,3R)-3-hydroxy-3-phenyl-4-(1,2,4-triazol-1-yl)butan-2-yl]benzamide Traditional Name: 2-amino-4-chloro-N-[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-3-(1,2,4-triazol-1-yl)propyl]benzamide Formula: C19H20ClN5O2 MolecularWeight: 385.8474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=CC=CC=C2)O)NC(=O)C3=C(C=C(C=C3)Cl)N

Isomeric SMILES

C[C@@H]([C@](CN1C=NC=N1)(C2=CC=CC=C2)O)NC(=O)C3=C(C=C(C=C3)Cl)N

InChI

InChI=1S/C19H20ClN5O2/c1-13(24-18(26)16-8-7-15(20)9-17(16)21)19(27,10-25-12-22-11-23-25)14-5-3-2-4-6-14/h2-9,11-13,27H,10,21H2,1H3,(H,24,26)/t13-,19+/m0/s1