3-[2-(oxidanylidenemethylidene)-1-piperazin-1-yl-pyrrolidin-3-yl]carbonylbenzenecarboximidamide

Systemtic Name: 3-[2-(oxidanylidenemethylidene)-1-piperazin-1-yl-pyrrolidin-3-yl]carbonylbenzenecarboximidamide Openeye Name: 3-[2-(oxomethylene)-1-piperazin-1-yl-pyrrolidine-3-carbonyl]benzamidine CAS Name: 3-[oxo-[2-(oxomethylidene)-1-(1-piperazinyl)-3-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[2-(oxomethylidene)-1-piperazin-1-ylpyrrolidine-3-carbonyl]benzenecarboximidamide Traditional Name: 3-[2-(ketomethylene)-1-piperazino-pyrrolidine-3-carbonyl]benzamidine Formula: C17H21N5O2 MolecularWeight: 327.38094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=C=O)C1C(=O)C2=CC(=CC=C2)C(=N)N)N3CCNCC3

Isomeric SMILES

C1CN(C(=C=O)C1C(=O)C2=CC(=CC=C2)C(=N)N)N3CCNCC3

InChI

InChI=1S/C17H21N5O2/c18-17(19)13-3-1-2-12(10-13)16(24)14-4-7-22(15(14)11-23)21-8-5-20-6-9-21/h1-3,10,14,20H,4-9H2,(H3,18,19)