2-(3-chlorophenyl)-5-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 2-(3-chlorophenyl)-5-methyl-N-[1-(phenylmethyl)pyrrolidin-3-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-chlorophenyl)-5-methyl-triazole-4-carboxamide CAS Name: 2-(3-chlorophenyl)-5-methyl-N-[1-(phenylmethyl)-3-pyrrolidinyl]-4-triazolecarboxamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-chlorophenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-(3-chlorophenyl)-5-methyl-triazole-4-carboxamide Formula: C21H22ClN5O MolecularWeight: 395.88528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2CCN(C2)CC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H22ClN5O/c1-15-20(25-27(24-15)19-9-5-8-17(22)12-19)21(28)23-18-10-11-26(14-18)13-16-6-3-2-4-7-16/h2-9,12,18H,10-11,13-14H2,1H3,(H,23,28)