[5-chloranyl-2-[3-[2-(dimethylamino)butyl]-5-(hydroxymethyl)-1,2,4-triazol-4-yl]phenyl]-phenyl-methanone

Systemtic Name: [5-chloranyl-2-[3-[2-(dimethylamino)butyl]-5-(hydroxymethyl)-1,2,4-triazol-4-yl]phenyl]-phenyl-methanone Openeye Name: [5-chloro-2-[3-[2-(dimethylamino)butyl]-5-(hydroxymethyl)-1,2,4-triazol-4-yl]phenyl]-phenyl-methanone CAS Name: [5-chloro-2-[3-[2-(dimethylamino)butyl]-5-(hydroxymethyl)-1,2,4-triazol-4-yl]phenyl]-phenylmethanone IUPAC Name: [5-chloro-2-[3-[2-(dimethylamino)butyl]-5-(hydroxymethyl)-1,2,4-triazol-4-yl]phenyl]-phenylmethanone Traditional Name: [5-chloro-2-[3-[2-(dimethylamino)butyl]-5-methylol-1,2,4-triazol-4-yl]phenyl]-phenyl-methanone Formula: C22H25ClN4O2 MolecularWeight: 412.9125

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=NN=C(N1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CO)N(C)C

Isomeric SMILES

CCC(CC1=NN=C(N1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CO)N(C)C

InChI

InChI=1S/C22H25ClN4O2/c1-4-17(26(2)3)13-20-24-25-21(14-28)27(20)19-11-10-16(23)12-18(19)22(29)15-8-6-5-7-9-15/h5-12,17,28H,4,13-14H2,1-3H3