4-(benzotriazol-1-ylmethyl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[(3R)-1-benzylpyrrolidin-3-yl]benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[(3R)-1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[(3R)-1-benzylpyrrolidin-3-yl]benzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[(3R)-1-benzylpyrrolidin-3-yl]benzamide Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)CC5=CC=CC=C5

Isomeric SMILES

C1CN(C[C@@H]1NC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)CC5=CC=CC=C5

InChI

InChI=1S/C25H25N5O/c31-25(26-22-14-15-29(18-22)16-19-6-2-1-3-7-19)21-12-10-20(11-13-21)17-30-24-9-5-4-8-23(24)27-28-30/h1-13,22H,14-18H2,(H,26,31)/t22-/m1/s1