3-chloranyl-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide

Systemtic Name: 3-chloranyl-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide Openeye Name: 3-chloro-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide CAS Name: 3-chloro-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide IUPAC Name: 3-chloro-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide Traditional Name: 3-chloro-N-(2-hydroxyethyl)-4-[4-methyl-5-(1-phenylcyclopropyl)-1,2,4-triazol-3-yl]benzamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1C2(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)C(=O)NCCO)Cl

Isomeric SMILES

CN1C(=NN=C1C2(CC2)C3=CC=CC=C3)C4=C(C=C(C=C4)C(=O)NCCO)Cl

InChI

InChI=1S/C21H21ClN4O2/c1-26-18(16-8-7-14(13-17(16)22)19(28)23-11-12-27)24-25-20(26)21(9-10-21)15-5-3-2-4-6-15/h2-8,13,27H,9-12H2,1H3,(H,23,28)