2-chloranyl-N-[2-(2-propan-2-ylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide

Systemtic Name: 2-chloranyl-N-[2-(2-propan-2-ylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide Openeye Name: 2-chloro-N-[2-(2-isopropylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide CAS Name: 2-chloro-N-[2-(2-propan-2-ylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide IUPAC Name: 2-chloro-N-[2-(2-propan-2-ylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide Traditional Name: 2-chloro-N-[2-(2-isopropylphenoxy)ethyl]-5-(1,2,4-triazol-4-yl)benzamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCCNC(=O)C2=C(C=CC(=C2)N3C=NN=C3)Cl

Isomeric SMILES

CC(C)C1=CC=CC=C1OCCNC(=O)C2=C(C=CC(=C2)N3C=NN=C3)Cl

InChI

InChI=1S/C20H21ClN4O2/c1-14(2)16-5-3-4-6-19(16)27-10-9-22-20(26)17-11-15(7-8-18(17)21)25-12-23-24-13-25/h3-8,11-14H,9-10H2,1-2H3,(H,22,26)