N-[4-(benzotriazol-1-ylcarbonyl)phenyl]-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(benzotriazol-1-ylcarbonyl)phenyl]-5-oxidanylidene-1-propan-2-yl-pyrrolidine-3-carboxamide Openeye Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-1-isopropyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-[1-benzotriazolyl(oxo)methyl]phenyl]-5-oxo-1-propan-2-yl-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide Traditional Name: N-[4-(benzotriazole-1-carbonyl)phenyl]-1-isopropyl-5-keto-pyrrolidine-3-carboxamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(C)N1CC(CC1=O)C(=O)NC2=CC=C(C=C2)C(=O)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H21N5O3/c1-13(2)25-12-15(11-19(25)27)20(28)22-16-9-7-14(8-10-16)21(29)26-18-6-4-3-5-17(18)23-24-26/h3-10,13,15H,11-12H2,1-2H3,(H,22,28)