2-[(2-oxidanyl-2-phenyl-ethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butanamide dihydrochloride

Systemtic Name: 2-[(2-oxidanyl-2-phenyl-ethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butanamide dihydrochloride Openeye Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butanamide dihydrochloride CAS Name: 2-[(2-hydroxy-2-phenylethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butanamide dihydrochloride IUPAC Name: 2-[(2-hydroxy-2-phenylethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butanamide dihydrochloride Traditional Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-N-phenyl-2-(1,2,4-triazol-1-yl)butyramide dihydrochloride Formula: C20H25Cl2N5O2 MolecularWeight: 438.3508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1)(NCC(C2=CC=CC=C2)O)N3C=NC=N3.Cl.Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1)(NCC(C2=CC=CC=C2)O)N3C=NC=N3.Cl.Cl

InChI

InChI=1S/C20H23N5O2.2ClH/c1-2-20(25-15-21-14-23-25,19(27)24-17-11-7-4-8-12-17)22-13-18(26)16-9-5-3-6-10-16;;/h3-12,14-15,18,22,26H,2,13H2,1H3,(H,24,27);2*1H