N-cyclohexyl-4-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-cyclohexyl-4-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-cyclohexyl-4-[(4-oxo-1H-quinazolin-2-yl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-cyclohexyl-4-[(4-oxo-1H-quinazolin-2-yl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-cyclohexyl-4-[(4-oxo-1H-quinazolin-2-yl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: N-cyclohexyl-4-[(4-keto-1H-quinazolin-2-yl)methyl]piperazin-4-ium-1-carboxamide Formula: C20H28N5O2+ MolecularWeight: 370.46862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CC[NH+](CC2)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H27N5O2/c26-19-16-8-4-5-9-17(16)22-18(23-19)14-24-10-12-25(13-11-24)20(27)21-15-6-2-1-3-7-15/h4-5,8-9,15H,1-3,6-7,10-14H2,(H,21,27)(H,22,23,26)/p+1