[5-chloranyl-2-[5-(dimethylaminomethyl)-3-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-1-yl]phenyl]-phenyl-methanone

Systemtic Name: [5-chloranyl-2-[5-(dimethylaminomethyl)-3-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-1-yl]phenyl]-phenyl-methanone Openeye Name: [5-chloro-2-[5-(dimethylaminomethyl)-3-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-1-yl]phenyl]-phenyl-methanone CAS Name: [5-chloro-2-[5-(dimethylaminomethyl)-3-(1-pyrrolidinylmethyl)-1,2,4-triazol-1-yl]phenyl]-phenylmethanone IUPAC Name: [5-chloro-2-[5-(dimethylaminomethyl)-3-(pyrrolidin-1-ylmethyl)-1,2,4-triazol-1-yl]phenyl]-phenylmethanone Traditional Name: [5-chloro-2-[5-(dimethylaminomethyl)-3-(pyrrolidinomethyl)-1,2,4-triazol-1-yl]phenyl]-phenyl-methanone Formula: C23H26ClN5O MolecularWeight: 423.93844

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NC(=NN1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CN4CCCC4

Isomeric SMILES

CN(C)CC1=NC(=NN1C2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC=C3)CN4CCCC4

InChI

InChI=1S/C23H26ClN5O/c1-27(2)16-22-25-21(15-28-12-6-7-13-28)26-29(22)20-11-10-18(24)14-19(20)23(30)17-8-4-3-5-9-17/h3-5,8-11,14H,6-7,12-13,15-16H2,1-2H3